A0A087X9F5_POEFO Loading...

COP9 signalosome complex subunit 6

Component of the COP9 signalosome complex (CSN), a complex involved in various cellular and developmental processes.

AlphaFold DB , UniProt , Accession A0A087X9F5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 316 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.3	Very low	33.1	Very low	247 Å²	247	137.9 Å²	137.9	100%	1.217	88%	0.876	S	S	*	*				0	100	0	-76.7	176.5	179	0	0	106.8
2	A	31.7	Very low	33.3	Very low	105 Å²	105	139.2 Å²	139.2	87%	0.868	87%	0.871	S	S	*	*			trans	-101.2	125.6	179.6	0	0	0	0	0	107.6
3	T	33.3	Very low	33.3	Very low	140 Å²	140	133.5 Å²	133.5	86%	0.859	86%	0.856	S	S	*	*			trans	-119.8	103.6	172.2	47	0	0	0	0	108
4	S	32.4	Very low	33.2	Very low	119 Å²	119	133.9 Å²	133.9	83%	0.832	86%	0.856	S	S	*	*			trans	-68.9	120.5	171	50.4	0	0	0	0	109.9	G6	S4-G6 PolarHBondContact O-N 3.32Å
5	N	33.4	Very low	33.9	Very low	170 Å²	170	131.3 Å²	131.3	91%	0.909	85%	0.851	S	S	*	*			trans	-85.7	102.4	173.8	-139	20.6	0	0	0	108.1	G7	N5-G7 PolarHBondContact O-N 3.13Å
6	G	30.1	Very low	34.8	Very low	75 Å²	75	129.4 Å²	129.4	77%	0.773	84%	0.842	S	S	*	*			trans	-77.3	107	174.6	0	0	0	0	0	110	S4 G8	S4-G6 PolarHBondContact O-N 3.32Å; G6-G8 PolarHBondContact O-N 3.05Å
7	G	29.8	Very low	36.3	Very low	80 Å²	80	128.1 Å²	128.1	83%	0.825	83%	0.833	S	S	*	*			trans	-72.5	100.8	167.4	0	0	0	0	0	109.6	N5 M9	N5-G7 PolarHBondContact O-N 3.13Å; G7-M9 PolarHBondContact O-N 3.04Å
8	G	28.2	Very low	38.6	Very low	72 Å²	72	125.4 Å²	125.4	74%	0.742	82%	0.818	S	S	*	*			trans	-70.9	118.2	165.4	0	0	0	0	0	109.1	G6 E10	G6-G8 PolarHBondContact O-N 3.05Å; G8-E10 PolarHBondContact O-N 2.8Å; G8-E10 VanDerWaalsContact O-N 3.16Å
9	M	34.6	Very low	41.1	Very low	181 Å²	181	119.6 Å²	119.6	89%	0.892	78%	0.78	S	S	*	*			trans	-60.1	110.5	161.4	-84.6	171.9	164.7	0	0	107.7	G7 V11	G7-M9 PolarHBondContact O-N 3.04Å; M9-V11 PolarHBondContact O-N 3.11Å; M9-V11 VanDerWaalsContact O-N 3.13Å
10	E	33	Very low	43.5	Very low	194 Å²	194	116.2 Å²	116.2	91%	0.907	75%	0.754	S	S	*	*			trans	-61.9	110.9	158	-77.5	-178.4	148.1	0	0	106.6	G8 D12	G8-E10 PolarHBondContact O-N 2.8Å; G8-E10 VanDerWaalsContact O-N 3.16Å; E10-D12 PolarHBondContact O-N 2.94Å
11	V	37.2	Very low	45.5	Very low	134 Å²	134	111.6 Å²	111.6	81%	0.812	73%	0.725	S	S	*	*			trans	-71.9	110.3	175.6	-153.4	0	0	0	0	105.6	M9 G13	M9-V11 PolarHBondContact O-N 3.11Å; M9-V11 VanDerWaalsContact O-N 3.13Å; V11-G13 PolarHBondContact O-N 3.44Å; V11-G13 VanDerWaalsContact O-N 3.13Å
12	D	35.8	Very low	47.2	Very low	153 Å²	153	105.2 Å²	105.2	82%	0.818	71%	0.705	S	S	*	*			trans	-47.3	118.3	173.8	-146.5	0.1	0	0	0	108.1	E10 T14	E10-D12 PolarHBondContact O-N 2.94Å; D12-T14 PolarHBondContact O-N 3.35Å; D12-T14 VanDerWaalsContact O-N 3.09Å
13	G	32.9	Very low	49.1	Very low	66 Å²	66	104.4 Å²	104.4	68%	0.68	71%	0.707	S	S	*	*			trans	-58.3	118.4	-178	0	0	0	0	0	108.5	V11 A15	V11-G13 PolarHBondContact O-N 3.44Å; V11-G13 VanDerWaalsContact O-N 3.13Å; G13-A15 PolarHBondContact O-N 2.59Å
14	T	32.3	Very low	51.1	Low	139 Å²	139	100.9 Å²	100.9	85%	0.853	69%	0.685	S	S	*	*			trans	-51.1	103.4	176.8	47.6	0	0	0	0	109.2	D12 S16	D12-T14 PolarHBondContact O-N 3.35Å; D12-T14 VanDerWaalsContact O-N 3.09Å; T14-S16 PolarHBondContact O-N 2.85Å; T14-S16 VanDerWaalsContact O-N 3.12Å
15	A	43.7	Very low	53.1	Low	94 Å²	94	101.3 Å²	101.3	78%	0.777	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-56.1	120.3	171.6	0	0	0	0	0	107.3	G13	G13-A15 PolarHBondContact O-N 2.59Å
16	S	49.1	Very low	54.8	Low	102 Å²	102	95 Å²	95	71%	0.713	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-49.3	134.9	171.6	44.2	0	0	0	0	109	T14 S18	T14-S16 PolarHBondContact O-N 2.85Å; T14-S16 VanDerWaalsContact O-N 3.12Å; S16-S18 PolarHBondContact O-N 2.84Å; S16-S18 VanDerWaalsContact O-N 3.16Å
17	P	60.4	Low	57.3	Low	106 Å²	106	94.4 Å²	94.4	69%	0.688	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-53.9	126.6	-177.5	20.7	-30.8	0	0	0	109.4	V19	P17-V19 PolarHBondContact O-N 3.31Å
18	S	76.5	Confident	60.1	Low	81 Å²	81	92 Å²	92	57%	0.566	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-60.6	122.9	179.7	176.3	0	0	0	0	109	S16 M20 L171	S16-S18 PolarHBondContact O-N 2.84Å; S16-S18 VanDerWaalsContact O-N 3.16Å; S18-M20 PolarHBondContact O-N 2.86Å; S18-M20 PolarHBondContact OG-N 2.97Å; S18-L171 WeakPolarHBondContact O-CD2 3.33Å
19	V	85.8	Confident	63	Low	14 Å²	14	91.4 Å²	91.4	9%	0.085	60%	0.595	C	S	.	*			trans	-80.2	2.6	176.2	-61.6	0	0	0	0	112.8	P17 P120 I125 L171 F172	P17-V19 PolarHBondContact O-N 3.31Å; V19-P120 HydrophobicContact CG2-CB 3.97Å; V19-P120 WeakPolarHBondContact CG2-O 3.49Å; V19-I125 HydrophobicContact CB-CD1 3.57Å; V19-I125 HydrophobicContact CB-CG1 4.26Å; V19-I125 HydrophobicContact CG1-CD1 3.4Å; V19-I125 VanDerWaalsContact CG1-CD1 3.4Å; V19-I125 HydrophobicContact CG1-CG1 4.28Å; V19-L171 CarbonylContact O-C 3.6Å; V19-L171 WeakPolarHBondContact O-CA 3.49Å; V19-F172 PolarHBondContact O-N 3.48Å
20	M	90.2	Very high	65.9	Low	52 Å²	52	82.8 Å²	82.8	26%	0.256	55%	0.553	S	S	.	*	B	Isolated β-bridge	trans	-103.3	134.5	-176.1	-61.1	-56.8	-61.9	0	0	111.6	S18 P120 Y157 F172	S18-M20 PolarHBondContact O-N 2.86Å; S18-M20 PolarHBondContact OG-N 2.97Å; M20-P120 HydrophobicContact SD-CB 3.99Å; M20-P120 HydrophobicContact SD-CG 3.77Å; M20-Y157 HydrophobicContact CE-CD1 3.77Å; M20-Y157 HydrophobicContact CE-CE1 3.49Å; M20-Y157 VanDerWaalsContact CE-CE1 3.49Å; M20-Y157 HydrophobicContact SD-CE1 4.25Å; M20-F172 CarbonylContact C-O 3.4Å; M20-F172 WeakPolarHBondContact CA-O 3.27Å; M20-F172 HydrophobicContact CE-CB 4.27Å; M20-F172 WeakPolarHBondContact CE-O 3.36Å; M20-F172 HydrophobicContact SD-CB 3.9Å
21	A	85.2	Confident	68.9	Low	19 Å²	19	74.7 Å²	74.7	16%	0.157	52%	0.519	C	S	.	.	P	Polyproline II helix	trans	-76.4	123.7	168.6	0	0	0	0	0	109.6	V24 L171 F172 A173	A21-V24 HydrophobicContact CB-CG2 4.12Å; A21-L171 HydrophobicContact CB-CB 3.96Å; A21-L171 HydrophobicContact CB-CD1 4.19Å; A21-F172 PolarHBondContact N-O 3.32Å; A21-A173 HydrophobicContact CB-CB 4.32Å
22	S	76.5	Confident	71.7	Confident	113 Å²	113	68.3 Å²	68.3	79%	0.79	48%	0.48	S	S	*	.	S	Bend	trans	-93.9	130	177.2	-65.1	0	0	0	0	110.5
23	G	70.9	Confident	74.6	Confident	88 Å²	88	61.5 Å²	61.5	91%	0.907	44%	0.444	S	S	*	.	S	Bend	trans	82	10.6	171.8	0	0	0	0	0	116.1
24	V	74.9	Confident	77.6	Confident	67 Å²	67	59.2 Å²	59.2	41%	0.406	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-96.3	127.9	173.6	-170.5	0	0	0	0	109.3	A21 V160 A173	A21-V24 HydrophobicContact CB-CG2 4.12Å; V24-V160 HydrophobicContact CG1-CG2 4.26Å; V24-A173 HydrophobicContact CB-CB 4.44Å
25	T	74.1	Confident	80.5	Confident	128 Å²	128	56 Å²	56	79%	0.785	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-85.7	137.4	172.8	53.5	0	0	0	0	110.3
26	G	70.8	Confident	83.1	Confident	36 Å²	36	51.6 Å²	51.6	37%	0.371	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-49.3	135.4	177.3	0	0	0	0	0	114.6	E158	G26-E158 WeakPolarHBondContact CA-OE1 3.38Å
27	S	81.2	Confident	85.4	Confident	64 Å²	64	48.1 Å²	48.1	45%	0.448	33%	0.33	S	S	.	.	S	Bend	trans	-83.7	-17.6	-178.2	79.8	0	0	0	0	114.1	E158	S27-E158 WeakPolarHBondContact CB-OE2 3.37Å; S27-E158 PolarHBondContact N-OE1 3.34Å; S27-E158 PolarHBondContact N-OE2 2.86Å; S27-E158 PolarHBondContact OG-OE2 3.33Å
28	V	88.3	Confident	87	Confident	28 Å²	28	47.5 Å²	47.5	17%	0.17	32%	0.321	C	S	.	.	S	Bend	trans	-129.5	153.6	-173	-66.1	0	0	0	0	112.8	V30 R68 I70 L139 L175	V28-V30 HydrophobicContact CG2-CG2 4.4Å; V28-R68 WeakPolarHBondContact CA-O 3.45Å; V28-R68 WeakPolarHBondContact CB-O 3.2Å; V28-I70 HydrophobicContact CB-CD1 4Å; V28-I70 HydrophobicContact CB-CG1 4.47Å; V28-I70 HydrophobicContact CG1-CD1 4.06Å; V28-I70 HydrophobicContact CG2-CD1 3.94Å; V28-L139 HydrophobicContact CG2-CD2 4.3Å; V28-L175 HydrophobicContact CG2-CD1 3.6Å; V28-L175 HydrophobicContact CG2-CD2 4.27Å
29	S	89.8	Confident	88	Confident	60 Å²	60	45.7 Å²	45.7	42%	0.42	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	126.9	173.1	178.3	0	0	0	0	109.5	R68 I70	S29-R68 PolarHBondContact N-O 3.13Å; S29-I70 PolarHBondContact O-N 2.97Å
30	V	95.6	Very high	88.6	Confident	1 Å²	1	45 Å²	45	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	125.2	-176.5	-177.2	0	0	0	0	111	V28 I70 V72 L139 V156 L175 Y177 T178	V28-V30 HydrophobicContact CG2-CG2 4.4Å; V30-I70 CarbonylContact C-O 3.59Å; V30-I70 WeakPolarHBondContact CA-O 3.39Å; V30-V72 HydrophobicContact CG1-CG2 4.03Å; V30-L139 HydrophobicContact CG1-CD1 4.4Å; V30-L139 HydrophobicContact CG2-CD1 4.15Å; V30-L139 HydrophobicContact CG2-CD2 4.26Å; V30-V156 HydrophobicContact CG1-CG1 4.41Å; V30-V156 HydrophobicContact CG2-CG1 4.27Å; V30-L175 HydrophobicContact CG2-CB 4.48Å; V30-L175 HydrophobicContact CG2-CD1 3.92Å; V30-Y177 CarbonylContact O-C 3.31Å; V30-Y177 WeakPolarHBondContact O-CA 3.19Å; V30-Y177 WeakPolarHBondContact O-CB 3.41Å; V30-T178 PolarHBondContact O-N 2.91Å
31	A	95.9	Very high	88.9	Confident	23 Å²	23	44.7 Å²	44.7	19%	0.19	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	115.9	169.4	0	0	0	0	0	108.8	I70 E71 V72 T178 A180	A31-I70 PolarHBondContact N-O 2.84Å; A31-E71 HydrophobicContact CB-CG 4.32Å; A31-E71 CarbonylContact O-C 3.59Å; A31-E71 WeakPolarHBondContact O-CA 3.41Å; A31-V72 PolarHBondContact O-N 2.91Å; A31-T178 CarbonylContact C-O 3.52Å; A31-T178 WeakPolarHBondContact CA-O 3.12Å; A31-A180 HydrophobicContact CB-CB 4.11Å
32	L	96.9	Very high	89.5	Confident	0 Å²	0	48 Å²	48	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	121.9	-173.5	178.7	63.4	0	0	0	110.8	V36 I37 V72 L141 V154 Y177 T178 L179 A180	L32-V36 HydrophobicContact CD1-CB 3.92Å; L32-V36 HydrophobicContact CD1-CG1 3.91Å; L32-V36 HydrophobicContact CD1-CG2 4.3Å; L32-I37 HydrophobicContact CD2-CD1 4.01Å; L32-I37 HydrophobicContact CD2-CG1 4.03Å; L32-I37 HydrophobicContact CG-CG1 4.45Å; L32-V72 HydrophobicContact CD1-CB 3.93Å; L32-V72 HydrophobicContact CD1-CG1 4Å; L32-L141 HydrophobicContact CD1-CD1 3.82Å; L32-L141 HydrophobicContact CD2-CD1 4.01Å; L32-V154 HydrophobicContact CD2-CG1 3.9Å; L32-Y177 HydrophobicContact CB-CD2 3.92Å; L32-Y177 HydrophobicContact CD2-CD2 4.03Å; L32-Y177 HydrophobicContact CD2-CE2 3.95Å; L32-T178 PolarHBondContact N-O 3.28Å; L32-L179 CarbonylContact O-C 3.59Å; L32-L179 WeakPolarHBondContact O-CA 3.34Å; L32-A180 PolarHBondContact O-N 3.32Å
33	H	96.2	Very high	90.5	Very high	10 Å²	10	43.2 Å²	43.2	5%	0.046	28%	0.284	C	S	.	.			trans	-77.4	134	174.8	-76.2	-106	0	0	0	111.8	L35 V36 E71 V72 A180 E185	H33-L35 PolarHBondContact O-N 3.34Å; H33-L35 VanDerWaalsContact O-N 3.16Å; H33-V36 HydrophobicContact CB-CG2 4.46Å; H33-V36 WeakPolarHBondContact O-CB 3.3Å; H33-V36 PolarHBondContact O-N 3.19Å; H33-E71 IonicContact CE1-OE1 3.85Å; H33-E71 WeakPolarHBondContact NE2-CG 3.32Å; H33-E71 IonicContact NE2-OE1 2.65Å; H33-E71 PolarHBondContact NE2-OE1 3.42Å; H33-V72 WeakPolarHBondContact CB-O 3.37Å; H33-V72 PolarHBondContact CD2-O 3.24Å; H33-V72 VanDerWaalsContact CD2-O 3.24Å; H33-V72 PolarHBondContact N-O 2.93Å; H33-A180 WeakPolarHBondContact NE2-CB 3.44Å; H33-E185 IonicContact CE1-OE2 2.63Å; H33-E185 IonicContact CG-OE2 2.71Å; H33-E185 IonicContact ND1-OE2 3.92Å; H33-E185 PolarHBondContact ND1-OE2 3.4Å
34	P	94.8	Very high	91.8	Very high	18 Å²	18	39.8 Å²	39.8	12%	0.117	24%	0.243	C	C	.	.	H	α-helix	trans	-51.2	-32.3	173.5	-30	33.6	0	0	0	115.1	V36 I37 L38 A180 E185 V189	P34-V36 PolarHBondContact O-N 3.31Å; P34-I37 WeakPolarHBondContact O-CB 3.15Å; P34-I37 PolarHBondContact O-N 3.19Å; P34-L38 PolarHBondContact O-N 3.09Å; P34-A180 WeakPolarHBondContact CD-O 3.48Å; P34-E185 VanDerWaalsContact CD-OE1 3.24Å; P34-E185 WeakPolarHBondContact CD-OE1 3.25Å; P34-V189 HydrophobicContact CB-CG2 3.72Å; P34-V189 HydrophobicContact CG-CG2 4.2Å
35	L	95	Very high	92.8	Very high	73 Å²	73	41 Å²	41	38%	0.382	25%	0.247	S	C	.	.	H	α-helix	trans	-53.1	-40.2	175.2	178.8	61	0	0	0	112.2	H33 I37 L38 N39 E185	H33-L35 PolarHBondContact O-N 3.34Å; H33-L35 VanDerWaalsContact O-N 3.16Å; L35-I37 VanDerWaalsContact C-N 3.34Å; L35-I37 PolarHBondContact O-N 3.19Å; L35-L38 PolarHBondContact O-N 3.13Å; L35-N39 WeakPolarHBondContact O-CB 3.4Å; L35-N39 VanDerWaalsContact O-CG 3.27Å; L35-N39 PolarHBondContact O-N 3.09Å; L35-N39 PolarHBondContact O-OD1 2.9Å; L35-E185 WeakPolarHBondContact CB-OE1 3.44Å; L35-E185 PolarHBondContact N-OE1 3.16Å
36	V	97.3	Very high	93.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.6	-43.7	178.7	176.7	0	0	0	0	110.5	L32 H33 P34 L38 N39 I40 L61 V72	L32-V36 HydrophobicContact CD1-CB 3.92Å; L32-V36 HydrophobicContact CD1-CG1 3.91Å; L32-V36 HydrophobicContact CD1-CG2 4.3Å; H33-V36 HydrophobicContact CB-CG2 4.46Å; H33-V36 WeakPolarHBondContact O-CB 3.3Å; H33-V36 PolarHBondContact O-N 3.19Å; P34-V36 PolarHBondContact O-N 3.31Å; V36-L38 VanDerWaalsContact C-N 3.33Å; V36-L38 PolarHBondContact O-N 2.55Å; V36-N39 PolarHBondContact O-N 3.36Å; V36-I40 HydrophobicContact CG1-CD1 3.89Å; V36-I40 WeakPolarHBondContact O-CG1 3.34Å; V36-I40 PolarHBondContact O-N 3.4Å; V36-L61 HydrophobicContact CG1-CD2 3.68Å; V36-V72 HydrophobicContact CG1-CG1 4.34Å; V36-V72 HydrophobicContact CG2-CG1 4.06Å
37	I	96.5	Very high	95.2	Very high	29 Å²	29	38.2 Å²	38.2	15%	0.149	21%	0.213	C	C	.	.	H	α-helix	trans	-63.3	-42.9	178.5	-56.1	175.9	0	0	0	110	L32 P34 L35 I40 S41 L143 L152 V154 L179	L32-I37 HydrophobicContact CD2-CD1 4.01Å; L32-I37 HydrophobicContact CD2-CG1 4.03Å; L32-I37 HydrophobicContact CG-CG1 4.45Å; P34-I37 WeakPolarHBondContact O-CB 3.15Å; P34-I37 PolarHBondContact O-N 3.19Å; L35-I37 VanDerWaalsContact C-N 3.34Å; L35-I37 PolarHBondContact O-N 3.19Å; I37-I40 PolarHBondContact O-N 3.36Å; I37-S41 WeakPolarHBondContact O-CB 3.19Å; I37-S41 PolarHBondContact O-N 3.16Å; I37-L143 HydrophobicContact CG2-CD1 3.97Å; I37-L152 HydrophobicContact CD1-CD2 4.09Å; I37-V154 HydrophobicContact CD1-CG2 4.43Å; I37-V154 HydrophobicContact CG1-CG2 4.46Å; I37-V154 HydrophobicContact CG2-CG2 4.5Å; I37-L179 HydrophobicContact CD1-CD2 4.01Å
38	L	94.9	Very high	95.8	Very high	93 Å²	93	40.3 Å²	40.3	49%	0.487	21%	0.211	S	C	.	.	H	α-helix	trans	-64.1	-44.1	177.2	-66.8	175.9	0	0	0	111.9	P34 L35 V36 I40 S41 D42	P34-L38 PolarHBondContact O-N 3.09Å; L35-L38 PolarHBondContact O-N 3.13Å; V36-L38 VanDerWaalsContact C-N 3.33Å; V36-L38 PolarHBondContact O-N 2.55Å; L38-I40 PolarHBondContact O-N 3.16Å; L38-S41 PolarHBondContact O-N 3.13Å; L38-D42 WeakPolarHBondContact O-CB 3.38Å; L38-D42 PolarHBondContact O-N 2.84Å
39	N	97.6	Very high	96.2	Very high	44 Å²	44	43.6 Å²	43.6	24%	0.235	24%	0.236	C	C	.	.	H	α-helix	trans	-60	-44.1	176.3	-73.6	-8.4	0	0	0	111.9	L35 V36 D42 H43 N74 S75	L35-N39 WeakPolarHBondContact O-CB 3.4Å; L35-N39 VanDerWaalsContact O-CG 3.27Å; L35-N39 PolarHBondContact O-N 3.09Å; L35-N39 PolarHBondContact O-OD1 2.9Å; V36-N39 PolarHBondContact O-N 3.36Å; N39-D42 PolarHBondContact O-N 3.33Å; N39-H43 VanDerWaalsContact O-CB 3.25Å; N39-H43 WeakPolarHBondContact O-CB 3.41Å; N39-H43 PolarHBondContact O-N 2.97Å; N39-N74 PolarHBondContact ND2-OD1 2.82Å; N39-N74 VanDerWaalsContact ND2-OD1 3.07Å; N39-S75 VanDerWaalsContact CB-OG 3.25Å; N39-S75 WeakPolarHBondContact CB-OG 3.03Å; N39-S75 PolarHBondContact ND2-O 3.18Å; N39-S75 PolarHBondContact ND2-OG 3.13Å
40	I	98.3	Very high	96.5	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-66	-43.2	178.7	-61.6	167.3	0	0	0	110.3	V36 I37 L38 H43 W44 Y114 T116 L141 L143	V36-I40 HydrophobicContact CG1-CD1 3.89Å; V36-I40 WeakPolarHBondContact O-CG1 3.34Å; V36-I40 PolarHBondContact O-N 3.4Å; I37-I40 PolarHBondContact O-N 3.36Å; L38-I40 PolarHBondContact O-N 3.16Å; I40-H43 PolarHBondContact O-N 3.12Å; I40-W44 WeakPolarHBondContact O-CB 3.48Å; I40-W44 PolarHBondContact O-N 2.8Å; I40-Y114 HydrophobicContact CB-CD2 4.26Å; I40-Y114 HydrophobicContact CB-CE2 4.21Å; I40-Y114 HydrophobicContact CD1-CD1 4.14Å; I40-Y114 HydrophobicContact CD1-CD2 3.88Å; I40-Y114 HydrophobicContact CD1-CE2 4.49Å; I40-Y114 HydrophobicContact CD1-CG 3.68Å; I40-Y114 HydrophobicContact CG1-CD1 3.99Å; I40-Y114 HydrophobicContact CG1-CD2 3.55Å; I40-Y114 HydrophobicContact CG1-CE1 4.08Å; I40-Y114 HydrophobicContact CG1-CE2 3.66Å; I40-Y114 HydrophobicContact CG1-CG 3.72Å; I40-Y114 HydrophobicContact CG2-CD2 3.81Å; I40-Y114 HydrophobicContact CG2-CE2 3.95Å; I40-T116 HydrophobicContact CG2-CG2 3.9Å; I40-L141 HydrophobicContact CD1-CD2 3.6Å; I40-L143 HydrophobicContact CB-CD1 4.15Å; I40-L143 HydrophobicContact CG2-CB 4.03Å; I40-L143 HydrophobicContact CG2-CD1 3.91Å; I40-L143 HydrophobicContact CG2-CG 4.39Å
41	S	96.8	Very high	96.4	Very high	45 Å²	45	52 Å²	52	32%	0.315	27%	0.268	S	S	.	.	H	α-helix	trans	-62.1	-46.3	176.8	-177.1	0	0	0	0	111.6	I37 L38 W44 I45	I37-S41 WeakPolarHBondContact O-CB 3.19Å; I37-S41 PolarHBondContact O-N 3.16Å; L38-S41 PolarHBondContact O-N 3.13Å; S41-W44 PolarHBondContact O-N 2.85Å; S41-I45 WeakPolarHBondContact O-CB 3.42Å; S41-I45 VanDerWaalsContact O-CG1 3.22Å; S41-I45 WeakPolarHBondContact O-CG1 3.48Å; S41-I45 PolarHBondContact O-N 3.22Å
42	D	97.3	Very high	96.3	Very high	88 Å²	88	54.3 Å²	54.3	47%	0.471	29%	0.294	S	S	.	.	H	α-helix	trans	-61.4	-47.4	176.4	172.1	69.4	0	0	0	111.5	L38 N39 W44 I45 R46	L38-D42 WeakPolarHBondContact O-CB 3.38Å; L38-D42 PolarHBondContact O-N 2.84Å; N39-D42 PolarHBondContact O-N 3.33Å; D42-W44 VanDerWaalsContact C-N 3.35Å; D42-W44 PolarHBondContact O-N 3.22Å; D42-I45 PolarHBondContact O-N 3.38Å; D42-R46 WeakPolarHBondContact O-CB 3.49Å; D42-R46 PolarHBondContact O-N 3.16Å; D42-R46 IonicContact OD1-NH1 3.79Å; D42-R46 IonicContact OD2-CZ 3.74Å; D42-R46 IonicContact OD2-NH1 2.62Å; D42-R46 PolarHBondContact OD2-NH1 2.87Å
43	H	98.1	Very high	96.1	Very high	12 Å²	12	60.9 Å²	60.9	6%	0.056	32%	0.319	C	S	.	.	H	α-helix	trans	-55.4	-49.8	175.9	-178.1	-168.9	0	0	0	111.2	N39 I40 R46 I47 I58 E77 Y114	N39-H43 VanDerWaalsContact O-CB 3.25Å; N39-H43 WeakPolarHBondContact O-CB 3.41Å; N39-H43 PolarHBondContact O-N 2.97Å; I40-H43 PolarHBondContact O-N 3.12Å; H43-R46 PolarHBondContact O-N 3.47Å; H43-I47 WeakPolarHBondContact O-CG1 3.41Å; H43-I47 PolarHBondContact O-N 2.86Å; H43-I58 PolarHBondContact CE1-O 3.1Å; H43-E77 HydrophobicContact CB-CG 4.49Å; H43-E77 IonicContact CD2-OE2 3.27Å; H43-E77 IonicContact NE2-OE2 3.6Å; H43-Y114 AromaticContact ND1-CE2 3.88Å; H43-Y114 AromaticContact ND1-CZ 3.83Å; H43-Y114 PolarHBondContact ND1-OH 3.41Å
44	W	97.7	Very high	95.9	Very high	16 Å²	16	64 Å²	64	6%	0.061	34%	0.341	C	S	.	.	H	α-helix	trans	-63	-44.7	178.5	-176.2	79	0	0	0	113	I40 S41 D42 R48 P54 M55 V57 T116 P145 M146	I40-W44 WeakPolarHBondContact O-CB 3.48Å; I40-W44 PolarHBondContact O-N 2.8Å; S41-W44 PolarHBondContact O-N 2.85Å; D42-W44 VanDerWaalsContact C-N 3.35Å; D42-W44 PolarHBondContact O-N 3.22Å; W44-R48 WeakPolarHBondContact O-CB 3.44Å; W44-R48 PolarHBondContact O-N 3.29Å; W44-P54 HydrophobicContact CZ2-CB 4.12Å; W44-M55 PolarHBondContact NE1-O 3.06Å; W44-M55 VanDerWaalsContact NE1-O 3.16Å; W44-V57 HydrophobicContact CB-CG2 4.06Å; W44-T116 HydrophobicContact CB-CG2 4.17Å; W44-T116 HydrophobicContact CG-CG2 4.2Å; W44-P145 HydrophobicContact CD2-CB 3.82Å; W44-P145 HydrophobicContact CD2-CG 3.64Å; W44-P145 HydrophobicContact CE3-CB 3.68Å; W44-P145 HydrophobicContact CE3-CG 4.04Å; W44-P145 HydrophobicContact CG-CG 4.14Å; W44-P145 HydrophobicContact CH2-CB 3.86Å; W44-P145 HydrophobicContact CH2-CG 3.95Å; W44-P145 HydrophobicContact CZ2-CB 4.02Å; W44-P145 HydrophobicContact CZ2-CG 3.57Å; W44-P145 HydrophobicContact CZ3-CB 3.71Å; W44-P145 HydrophobicContact CZ3-CG 4.19Å; W44-M146 HydrophobicContact CH2-CG 4.27Å; W44-M146 HydrophobicContact CH2-SD 3.75Å; W44-M146 HydrophobicContact CZ2-CG 4.25Å; W44-M146 HydrophobicContact CZ2-SD 4.24Å
45	I	97.1	Very high	95.8	Very high	94 Å²	94	65.8 Å²	65.8	48%	0.482	35%	0.348	S	S	.	.	H	α-helix	trans	-63.6	-43	179.2	-70.6	170.4	0	0	0	110.7	S41 D42 R48 S49	S41-I45 WeakPolarHBondContact O-CB 3.42Å; S41-I45 VanDerWaalsContact O-CG1 3.22Å; S41-I45 WeakPolarHBondContact O-CG1 3.48Å; S41-I45 PolarHBondContact O-N 3.22Å; D42-I45 PolarHBondContact O-N 3.38Å; I45-R48 PolarHBondContact O-N 3.27Å; I45-S49 WeakPolarHBondContact O-CB 3.4Å; I45-S49 PolarHBondContact O-N 2.84Å
46	R	97.3	Very high	95.7	Very high	69 Å²	69	66.1 Å²	66.1	26%	0.26	35%	0.347	S	S	.	.	H	α-helix	trans	-62.9	-50	179.5	-179.1	175.8	57.7	-100.6	-5	111.5	D42 H43 R48 S49 Q50 E77	D42-R46 WeakPolarHBondContact O-CB 3.49Å; D42-R46 PolarHBondContact O-N 3.16Å; D42-R46 IonicContact OD1-NH1 3.79Å; D42-R46 IonicContact OD2-CZ 3.74Å; D42-R46 IonicContact OD2-NH1 2.62Å; D42-R46 PolarHBondContact OD2-NH1 2.87Å; H43-R46 PolarHBondContact O-N 3.47Å; R46-R48 VanDerWaalsContact C-N 3.35Å; R46-R48 PolarHBondContact O-N 3.02Å; R46-S49 WeakPolarHBondContact O-CB 3.32Å; R46-S49 PolarHBondContact O-N 2.79Å; R46-S49 VanDerWaalsContact O-N 3.15Å; R46-Q50 WeakPolarHBondContact O-CG 3.22Å; R46-Q50 PolarHBondContact O-N 3.04Å; R46-E77 IonicContact CZ-OE1 2.85Å; R46-E77 IonicContact CZ-OE2 2.67Å; R46-E77 IonicContact NH2-OE1 3.48Å; R46-E77 PolarHBondContact NH2-OE1 3.46Å; R46-E77 IonicContact NH2-OE2 2.83Å; R46-E77 PolarHBondContact NH2-OE2 2.97Å
47	I	96.1	Very high	95.7	Very high	36 Å²	36	66.3 Å²	66.3	19%	0.185	35%	0.349	C	S	.	.	H	α-helix	trans	-63.8	-43.3	178.9	-61.3	-59.1	0	0	0	110.5	H43 S49 Q50 E51 M55 V57	H43-I47 WeakPolarHBondContact O-CG1 3.41Å; H43-I47 PolarHBondContact O-N 2.86Å; I47-S49 PolarHBondContact O-N 3.08Å; I47-Q50 PolarHBondContact O-N 2.86Å; I47-Q50 VanDerWaalsContact O-N 3.13Å; I47-E51 HydrophobicContact CG2-CG 4.2Å; I47-E51 WeakPolarHBondContact O-CB 3.41Å; I47-E51 PolarHBondContact O-N 2.9Å; I47-M55 HydrophobicContact CG2-CB 3.73Å; I47-M55 HydrophobicContact CG2-CG 4.08Å; I47-V57 HydrophobicContact CB-CG1 3.94Å; I47-V57 HydrophobicContact CG1-CG1 3.78Å; I47-V57 HydrophobicContact CG2-CG1 4.32Å
48	R	95.4	Very high	95.8	Very high	107 Å²	107	65.4 Å²	65.4	40%	0.404	34%	0.344	S	S	.	.	H	α-helix	trans	-57.5	-38.5	174.5	176.7	179.4	172.3	-166.7	-2.1	112.3	W44 I45 R46 G52 R53	W44-R48 WeakPolarHBondContact O-CB 3.44Å; W44-R48 PolarHBondContact O-N 3.29Å; I45-R48 PolarHBondContact O-N 3.27Å; R46-R48 VanDerWaalsContact C-N 3.35Å; R46-R48 PolarHBondContact O-N 3.02Å; R48-G52 WeakPolarHBondContact O-CA 3.15Å; R48-G52 PolarHBondContact O-N 3.38Å; R48-R53 WeakPolarHBondContact CA-O 3.39Å; R48-R53 PolarHBondContact O-N 3.32Å
49	S	96	Very high	96	Very high	98 Å²	98	61 Å²	61	69%	0.685	32%	0.321	S	S	*	.	H	α-helix	trans	-70.8	-35.1	177.7	-172.7	0	0	0	0	112.7	I45 R46 I47	I45-S49 WeakPolarHBondContact O-CB 3.4Å; I45-S49 PolarHBondContact O-N 2.84Å; R46-S49 WeakPolarHBondContact O-CB 3.32Å; R46-S49 PolarHBondContact O-N 2.79Å; R46-S49 VanDerWaalsContact O-N 3.15Å; I47-S49 PolarHBondContact O-N 3.08Å
50	Q	95.3	Very high	96	Very high	128 Å²	128	58.9 Å²	58.9	60%	0.598	31%	0.309	S	S	*	.	H	α-helix	trans	-71.8	-42.3	178.1	-71.8	172.5	-7	0	0	111.6	R46 I47	R46-Q50 WeakPolarHBondContact O-CG 3.22Å; R46-Q50 PolarHBondContact O-N 3.04Å; I47-Q50 PolarHBondContact O-N 2.86Å; I47-Q50 VanDerWaalsContact O-N 3.13Å
51	E	94.3	Very high	96	Very high	108 Å²	108	59 Å²	59	51%	0.505	31%	0.31	S	S	.	.	H	α-helix	trans	-89.9	-12.7	-175	-65.4	-65.6	149	0	0	113.4	I47 R53 M55	I47-E51 HydrophobicContact CG2-CG 4.2Å; I47-E51 WeakPolarHBondContact O-CB 3.41Å; I47-E51 PolarHBondContact O-N 2.9Å; E51-R53 HydrophobicContact CB-CG 4.34Å; E51-R53 PolarHBondContact O-N 2.98Å; E51-R53 VanDerWaalsContact O-N 3.17Å; E51-M55 HydrophobicContact CB-CG 3.95Å; E51-M55 HydrophobicContact CG-CG 3.98Å
52	G	93.6	Very high	96.1	Very high	72 Å²	72	57 Å²	57	74%	0.742	30%	0.296	S	S	*	.	S	Bend	trans	69.6	5.3	-177.2	0	0	0	0	0	114.8	R48	R48-G52 WeakPolarHBondContact O-CA 3.15Å; R48-G52 PolarHBondContact O-N 3.38Å
53	R	93.1	Very high	96	Very high	139 Å²	139	52.8 Å²	52.8	53%	0.525	27%	0.273	S	S	.	.	S	Bend	trans	-145	155.7	-180	64.9	-174.9	176.8	101.7	0	111.2	R48 E51 M55	R48-R53 WeakPolarHBondContact CA-O 3.39Å; R48-R53 PolarHBondContact O-N 3.32Å; E51-R53 HydrophobicContact CB-CG 4.34Å; E51-R53 PolarHBondContact O-N 2.98Å; E51-R53 VanDerWaalsContact O-N 3.17Å; R53-M55 HydrophobicContact CG-CG 4.44Å; R53-M55 HydrophobicContact CG-SD 4.11Å; R53-M55 PolarHBondContact NH1-SD 3.38Å; R53-M55 PolarHBondContact NH2-SD 2.86Å; R53-M55 VanDerWaalsContact NH2-SD 3.4Å; R53-M55 PolarHBondContact O-N 3.15Å
54	P	91.8	Very high	95.9	Very high	76 Å²	76	55.2 Å²	55.2	49%	0.494	28%	0.284	S	S	.	.			trans	-58.5	128.3	172.8	-23.5	35.1	0	0	0	111.1	W44	W44-P54 HydrophobicContact CZ2-CB 4.12Å
55	M	92.4	Very high	95.7	Very high	54 Å²	54	59.4 Å²	59.4	27%	0.266	30%	0.304	S	S	.	.			trans	-124	146	176.2	-67.4	-61.3	-70.8	0	0	109.5	W44 I47 E51 R53	W44-M55 PolarHBondContact NE1-O 3.06Å; W44-M55 VanDerWaalsContact NE1-O 3.16Å; I47-M55 HydrophobicContact CG2-CB 3.73Å; I47-M55 HydrophobicContact CG2-CG 4.08Å; E51-M55 HydrophobicContact CB-CG 3.95Å; E51-M55 HydrophobicContact CG-CG 3.98Å; R53-M55 HydrophobicContact CG-CG 4.44Å; R53-M55 HydrophobicContact CG-SD 4.11Å; R53-M55 PolarHBondContact NH1-SD 3.38Å; R53-M55 PolarHBondContact NH2-SD 2.86Å; R53-M55 VanDerWaalsContact NH2-SD 3.4Å; R53-M55 PolarHBondContact O-N 3.15Å
56	Q	93.8	Very high	95.4	Very high	80 Å²	80	62 Å²	62	37%	0.374	31%	0.314	S	S	.	.			trans	-69	131.1	167.1	-177	176.7	18.5	0	0	108.4	T115	Q56-T115 WeakPolarHBondContact CG-OG1 3.43Å; Q56-T115 PolarHBondContact NE2-OG1 3.45Å
57	V	96.9	Very high	95.1	Very high	5 Å²	5	61.6 Å²	61.6	3%	0.03	33%	0.331	C	S	.	.			trans	-110.5	148.5	172.4	-63.3	0	0	0	0	110	W44 I47 Y114 T115 T116	W44-V57 HydrophobicContact CB-CG2 4.06Å; I47-V57 HydrophobicContact CB-CG1 3.94Å; I47-V57 HydrophobicContact CG1-CG1 3.78Å; I47-V57 HydrophobicContact CG2-CG1 4.32Å; V57-Y114 HydrophobicContact CG2-CE2 4.42Å; V57-T115 WeakPolarHBondContact O-CA 3.32Å; V57-T115 WeakPolarHBondContact O-CB 3.44Å; V57-T115 PolarHBondContact O-OG1 3.48Å; V57-T116 HydrophobicContact CG2-CG2 3.56Å; V57-T116 PolarHBondContact N-OG1 3.47Å; V57-T116 PolarHBondContact O-N 3.18Å
58	I	98.1	Very high	94.8	Very high	9 Å²	9	68.9 Å²	68.9	5%	0.046	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	139.1	-179.2	-62.6	168.7	0	0	0	108.5	H43 L78 V87 W113 Y114 I127	H43-I58 PolarHBondContact CE1-O 3.1Å; I58-L78 HydrophobicContact CG2-CB 4.39Å; I58-L78 HydrophobicContact CG2-CD1 4.43Å; I58-L78 PolarHBondContact O-N 3.02Å; I58-L78 VanDerWaalsContact O-N 3.08Å; I58-V87 HydrophobicContact CD1-CG1 3.6Å; I58-W113 HydrophobicContact CG2-CE3 4.09Å; I58-W113 HydrophobicContact CG2-CZ3 4.45Å; I58-Y114 WeakPolarHBondContact CA-O 3.27Å; I58-I127 HydrophobicContact CD1-CD1 3.72Å
59	G	98.3	Very high	94.6	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	176.8	174.3	0	0	0	0	0	114.5	F76 W113 Y114	G59-F76 CarbonylContact C-O 3.46Å; G59-F76 WeakPolarHBondContact CA-O 3.41Å; G59-W113 CarbonylContact O-C 3.44Å; G59-W113 WeakPolarHBondContact O-CA 3.08Å; G59-W113 WeakPolarHBondContact O-CB 3.25Å; G59-Y114 VanDerWaalsContact C-CD1 3.47Å; G59-Y114 VanDerWaalsContact CA-CZ 3.45Å; G59-Y114 PolarHBondContact N-O 2.89Å; G59-Y114 VanDerWaalsContact N-O 3.07Å; G59-Y114 WeakPolarHBondContact O-CD1 3.45Å; G59-Y114 PolarHBondContact O-N 2.83Å
60	A	98.3	Very high	94.6	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	145.7	-177.6	0	0	0	0	0	111.2	S75 F76 L78 F110	A60-S75 WeakPolarHBondContact O-CA 3.43Å; A60-S75 WeakPolarHBondContact O-CB 3.22Å; A60-F76 HydrophobicContact CB-CD1 3.95Å; A60-F76 HydrophobicContact CB-CD2 4Å; A60-F76 HydrophobicContact CB-CE1 3.56Å; A60-F76 HydrophobicContact CB-CE2 3.6Å; A60-F76 HydrophobicContact CB-CG 4.16Å; A60-F76 HydrophobicContact CB-CZ 3.36Å; A60-F76 PolarHBondContact N-O 2.89Å; A60-F76 PolarHBondContact O-N 3.45Å; A60-F76 VanDerWaalsContact O-N 3.09Å; A60-L78 HydrophobicContact CB-CD1 4.13Å; A60-L78 HydrophobicContact CB-CD2 4.14Å; A60-L78 HydrophobicContact CB-CG 4.05Å; A60-F110 HydrophobicContact CB-CD2 4.02Å; A60-F110 HydrophobicContact CB-CE2 3.52Å
61	L	98.5	Very high	94.7	Very high	2 Å²	2	61.4 Å²	61.4	1%	0.01	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	131.1	170.2	-62.3	175	0	0	0	108.8	V36 V72 F110 L111 G112 W113 Y114 L141	V36-L61 HydrophobicContact CG1-CD2 3.68Å; L61-V72 HydrophobicContact CB-CG1 4.05Å; L61-V72 HydrophobicContact CD1-CG1 4.43Å; L61-V72 HydrophobicContact CD2-CG1 3.95Å; L61-V72 HydrophobicContact CG-CG1 4.37Å; L61-F110 WeakPolarHBondContact O-CD2 3.47Å; L61-L111 PolarHBondContact O-N 3.22Å; L61-G112 PolarHBondContact N-O 3.08Å; L61-W113 WeakPolarHBondContact CD1-O 3.44Å; L61-Y114 HydrophobicContact CD2-CD1 3.77Å; L61-Y114 HydrophobicContact CD2-CG 4.38Å; L61-Y114 HydrophobicContact CG-CD1 4.26Å; L61-L141 HydrophobicContact CD1-CB 3.72Å; L61-L141 HydrophobicContact CD1-CD1 4.45Å
62	I	97.8	Very high	94.8	Very high	3 Å²	3	56.3 Å²	56.3	2%	0.015	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	153.2	177.9	64.6	173.4	0	0	0	111.3	M73 N74 F76 F101 M108 E109 F110	I62-M73 PolarHBondContact O-N 3.21Å; I62-N74 HydrophobicContact CD1-CB 4.08Å; I62-N74 HydrophobicContact CG1-CB 3.78Å; I62-N74 PolarHBondContact N-O 3.42Å; I62-N74 PolarHBondContact O-N 2.68Å; I62-N74 VanDerWaalsContact O-O 3.1Å; I62-F76 HydrophobicContact CD1-CD1 4.43Å; I62-F76 HydrophobicContact CG2-CD1 4.29Å; I62-F76 HydrophobicContact CG2-CE1 3.71Å; I62-F101 HydrophobicContact CD1-CD2 4.19Å; I62-F101 HydrophobicContact CD1-CG 4.35Å; I62-F101 HydrophobicContact CG2-CE1 4.08Å; I62-F101 HydrophobicContact CG2-CE2 4.38Å; I62-F101 HydrophobicContact CG2-CZ 3.95Å; I62-M108 HydrophobicContact CD1-SD 4.07Å; I62-M108 HydrophobicContact CG1-SD 4.3Å; I62-E109 WeakPolarHBondContact CA-O 3.47Å; I62-E109 WeakPolarHBondContact CB-O 3.38Å; I62-F110 HydrophobicContact CG2-CD2 4.45Å
63	G	96.9	Very high	94.9	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.8	-148.3	-179.7	0	0	0	0	0	112	E71 M108 E109	G63-E71 CarbonylContact C-O 3.51Å; G63-E71 VanDerWaalsContact CA-O 3.26Å; G63-E71 WeakPolarHBondContact CA-O 3.34Å; G63-M108 CarbonylContact O-C 3.58Å; G63-M108 VanDerWaalsContact O-CA 3.27Å; G63-M108 WeakPolarHBondContact O-CA 3.49Å; G63-E109 PolarHBondContact N-O 3.38Å; G63-E109 PolarHBondContact O-N 2.83Å
64	K	95.4	Very high	95.1	Very high	63 Å²	63	49.6 Å²	49.6	27%	0.274	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	148.5	-175.8	-63	-172.9	-172.6	-169.6	0	111.1	E71 M73 E107	K64-E71 PolarHBondContact N-O 3.35Å; K64-E71 PolarHBondContact O-N 3.38Å; K64-M73 HydrophobicContact CD-SD 4.22Å; K64-M73 HydrophobicContact CG-SD 3.92Å; K64-E107 IonicContact NZ-OE2 2.84Å; K64-E107 PolarHBondContact NZ-OE2 3.49Å
65	Q	93.4	Very high	95.4	Very high	104 Å²	104	46.4 Å²	46.4	49%	0.486	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	119.8	172.6	-179.7	172.7	-6.2	0	0	110	G67 I70 L111	Q65-G67 PolarHBondContact NE2-O 3.1Å; Q65-G67 VanDerWaalsContact NE2-O 3.1Å; Q65-I70 HydrophobicContact CG-CG1 4.1Å; Q65-L111 HydrophobicContact CB-CD2 4.29Å
66	E	91.3	Very high	95.6	Very high	149 Å²	149	45.5 Å²	45.5	70%	0.696	23%	0.226	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-116.2	90.4	174.9	-66.4	-170.2	173.1	0	0	109.4	R68 N69	E66-R68 PolarHBondContact O-N 3.41Å; E66-R68 VanDerWaalsContact O-N 3.08Å; E66-N69 PolarHBondContact N-O 3.07Å; E66-N69 PolarHBondContact O-N 3.41Å
67	G	90.5	Very high	95.8	Very high	60 Å²	60	45.5 Å²	45.5	62%	0.619	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.3	-110.5	-174.4	0	0	0	0	0	111.5	Q65	Q65-G67 PolarHBondContact NE2-O 3.1Å; Q65-G67 VanDerWaalsContact NE2-O 3.1Å
68	R	89.8	Confident	95.8	Very high	190 Å²	190	46.1 Å²	46.1	72%	0.717	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-0.6	178.2	-65.9	-174	-177.8	-179.8	-0.1	113.7	V28 S29 E66	V28-R68 WeakPolarHBondContact CA-O 3.45Å; V28-R68 WeakPolarHBondContact CB-O 3.2Å; S29-R68 PolarHBondContact N-O 3.13Å; E66-R68 PolarHBondContact O-N 3.41Å; E66-R68 VanDerWaalsContact O-N 3.08Å
69	N	91.6	Very high	95.7	Very high	96 Å²	96	49.6 Å²	49.6	51%	0.513	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	117.9	176.2	-60.4	-35.4	0	0	0	108.2	E66	E66-N69 PolarHBondContact N-O 3.07Å; E66-N69 PolarHBondContact O-N 3.41Å
70	I	95.6	Very high	95.4	Very high	10 Å²	10	51.9 Å²	51.9	5%	0.051	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	121.1	177.8	-57.5	175	0	0	0	108	V28 S29 V30 A31 Q65 V72 L111 L139	V28-I70 HydrophobicContact CB-CD1 4Å; V28-I70 HydrophobicContact CB-CG1 4.47Å; V28-I70 HydrophobicContact CG1-CD1 4.06Å; V28-I70 HydrophobicContact CG2-CD1 3.94Å; S29-I70 PolarHBondContact O-N 2.97Å; V30-I70 CarbonylContact C-O 3.59Å; V30-I70 WeakPolarHBondContact CA-O 3.39Å; A31-I70 PolarHBondContact N-O 2.84Å; Q65-I70 HydrophobicContact CG-CG1 4.1Å; I70-V72 HydrophobicContact CG2-CG2 4.26Å; I70-L111 HydrophobicContact CG2-CB 4.44Å; I70-L111 HydrophobicContact CG2-CD1 3.64Å; I70-L111 HydrophobicContact CG2-CD2 4.03Å; I70-L111 HydrophobicContact CG2-CG 4.26Å; I70-L139 HydrophobicContact CB-CD1 4.19Å; I70-L139 HydrophobicContact CD1-CD1 3.98Å; I70-L139 HydrophobicContact CD1-CD2 4.14Å; I70-L139 HydrophobicContact CD1-CG 4.09Å; I70-L139 HydrophobicContact CG2-CD1 3.57Å
71	E	96.6	Very high	95.1	Very high	69 Å²	69	56.3 Å²	56.3	32%	0.322	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	108	177.5	-170.9	176.3	-144.9	0	0	109.2	A31 H33 G63 K64 M73 L111	A31-E71 HydrophobicContact CB-CG 4.32Å; A31-E71 CarbonylContact O-C 3.59Å; A31-E71 WeakPolarHBondContact O-CA 3.41Å; H33-E71 IonicContact CE1-OE1 3.85Å; H33-E71 WeakPolarHBondContact NE2-CG 3.32Å; H33-E71 IonicContact NE2-OE1 2.65Å; H33-E71 PolarHBondContact NE2-OE1 3.42Å; G63-E71 CarbonylContact C-O 3.51Å; G63-E71 VanDerWaalsContact CA-O 3.26Å; G63-E71 WeakPolarHBondContact CA-O 3.34Å; K64-E71 PolarHBondContact N-O 3.35Å; K64-E71 PolarHBondContact O-N 3.38Å; E71-M73 HydrophobicContact CB-CG 4.5Å; E71-M73 HydrophobicContact CG-CG 3.84Å; E71-M73 PolarHBondContact O-N 2.79Å; E71-L111 WeakPolarHBondContact O-CD1 3.46Å
72	V	97.8	Very high	94.8	Very high	2 Å²	2	61.1 Å²	61.1	1%	0.012	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	100.4	-179.7	-170.9	0	0	0	0	108.5	V30 A31 L32 H33 V36 L61 I70 L111 L139	V30-V72 HydrophobicContact CG1-CG2 4.03Å; A31-V72 PolarHBondContact O-N 2.91Å; L32-V72 HydrophobicContact CD1-CB 3.93Å; L32-V72 HydrophobicContact CD1-CG1 4Å; H33-V72 WeakPolarHBondContact CB-O 3.37Å; H33-V72 PolarHBondContact CD2-O 3.24Å; H33-V72 VanDerWaalsContact CD2-O 3.24Å; H33-V72 PolarHBondContact N-O 2.93Å; V36-V72 HydrophobicContact CG1-CG1 4.34Å; V36-V72 HydrophobicContact CG2-CG1 4.06Å; L61-V72 HydrophobicContact CB-CG1 4.05Å; L61-V72 HydrophobicContact CD1-CG1 4.43Å; L61-V72 HydrophobicContact CD2-CG1 3.95Å; L61-V72 HydrophobicContact CG-CG1 4.37Å; I70-V72 HydrophobicContact CG2-CG2 4.26Å; V72-L111 HydrophobicContact CG2-CD1 4.18Å; V72-L139 HydrophobicContact CG2-CD1 3.98Å
73	M	96	Very high	94.5	Very high	36 Å²	36	65.3 Å²	65.3	18%	0.177	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	-34.7	-167.5	-57.6	-178	83.5	0	0	113.4	I62 K64 E71 M108	I62-M73 PolarHBondContact O-N 3.21Å; K64-M73 HydrophobicContact CD-SD 4.22Å; K64-M73 HydrophobicContact CG-SD 3.92Å; E71-M73 HydrophobicContact CB-CG 4.5Å; E71-M73 HydrophobicContact CG-CG 3.84Å; E71-M73 PolarHBondContact O-N 2.79Å; M73-M108 HydrophobicContact CB-CE 4.07Å; M73-M108 HydrophobicContact CE-CE 4.28Å; M73-M108 HydrophobicContact SD-CE 3.87Å
74	N	96.4	Very high	94	Very high	33 Å²	33	72.3 Å²	72.3	18%	0.176	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	170.4	-175.1	-156	-9.3	0	0	0	111.1	N39 I62	N39-N74 PolarHBondContact ND2-OD1 2.82Å; N39-N74 VanDerWaalsContact ND2-OD1 3.07Å; I62-N74 HydrophobicContact CD1-CB 4.08Å; I62-N74 HydrophobicContact CG1-CB 3.78Å; I62-N74 PolarHBondContact N-O 3.42Å; I62-N74 PolarHBondContact O-N 2.68Å; I62-N74 VanDerWaalsContact O-O 3.1Å
75	S	98	Very high	93.7	Very high	9 Å²	9	78.4 Å²	78.4	6%	0.063	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	154.6	-179.3	62.1	0	0	0	0	111.5	N39 A60	N39-S75 VanDerWaalsContact CB-OG 3.25Å; N39-S75 WeakPolarHBondContact CB-OG 3.03Å; N39-S75 PolarHBondContact ND2-O 3.18Å; N39-S75 PolarHBondContact ND2-OG 3.13Å; A60-S75 WeakPolarHBondContact O-CA 3.43Å; A60-S75 WeakPolarHBondContact O-CB 3.22Å
76	F	97.6	Very high	93.5	Very high	35 Å²	35	79.2 Å²	79.2	15%	0.154	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	164.1	175.3	64.1	-94.1	0	0	0	111.6	G59 A60 I62 L78 Y94 K97 F101	G59-F76 CarbonylContact C-O 3.46Å; G59-F76 WeakPolarHBondContact CA-O 3.41Å; A60-F76 HydrophobicContact CB-CD1 3.95Å; A60-F76 HydrophobicContact CB-CD2 4Å; A60-F76 HydrophobicContact CB-CE1 3.56Å; A60-F76 HydrophobicContact CB-CE2 3.6Å; A60-F76 HydrophobicContact CB-CG 4.16Å; A60-F76 HydrophobicContact CB-CZ 3.36Å; A60-F76 PolarHBondContact N-O 2.89Å; A60-F76 PolarHBondContact O-N 3.45Å; A60-F76 VanDerWaalsContact O-N 3.09Å; I62-F76 HydrophobicContact CD1-CD1 4.43Å; I62-F76 HydrophobicContact CG2-CD1 4.29Å; I62-F76 HydrophobicContact CG2-CE1 3.71Å; F76-L78 HydrophobicContact CE2-CD2 3.89Å; F76-Y94 HydrophobicContact CZ-CD2 4.28Å; F76-Y94 HydrophobicContact CZ-CE2 4.33Å; F76-K97 HydrophobicContact CD2-CB 4.36Å; F76-K97 HydrophobicContact CD2-CD 4.49Å; F76-K97 HydrophobicContact CD2-CG 4.39Å; F76-K97 HydrophobicContact CE2-CB 3.68Å; F76-K97 HydrophobicContact CE2-CG 4.1Å; F76-K97 HydrophobicContact CZ-CB 4.1Å; F76-F101 HydrophobicContact CD1-CD1 4.39Å; F76-F101 AromaticContact CE1-CD1 3.56Å; F76-F101 HydrophobicContact CE1-CD1 3.56Å; F76-F101 AromaticContact CE1-CE1 3.62Å; F76-F101 HydrophobicContact CE1-CE1 3.62Å; F76-F101 AromaticContact CZ-CD1 3.97Å; F76-F101 HydrophobicContact CZ-CD1 3.97Å; F76-F101 AromaticContact CZ-CE1 3.89Å; F76-F101 HydrophobicContact CZ-CE1 3.89Å
77	E	97.6	Very high	93.6	Very high	81 Å²	81	73.4 Å²	73.4	38%	0.379	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	137.3	-174.5	-55.1	167.3	-131.9	0	0	110.6	H43 R46	H43-E77 HydrophobicContact CB-CG 4.49Å; H43-E77 IonicContact CD2-OE2 3.27Å; H43-E77 IonicContact NE2-OE2 3.6Å; R46-E77 IonicContact CZ-OE1 2.85Å; R46-E77 IonicContact CZ-OE2 2.67Å; R46-E77 IonicContact NH2-OE1 3.48Å; R46-E77 PolarHBondContact NH2-OE1 3.46Å; R46-E77 IonicContact NH2-OE2 2.83Å; R46-E77 PolarHBondContact NH2-OE2 2.97Å
78	L	96.8	Very high	93.9	Very high	17 Å²	17	73.6 Å²	73.6	9%	0.089	36%	0.361	C	S	.	.			trans	-104.1	148	172.8	-72.6	175.1	0	0	0	110.3	I58 A60 F76 I89 Y94	I58-L78 HydrophobicContact CG2-CB 4.39Å; I58-L78 HydrophobicContact CG2-CD1 4.43Å; I58-L78 PolarHBondContact O-N 3.02Å; I58-L78 VanDerWaalsContact O-N 3.08Å; A60-L78 HydrophobicContact CB-CD1 4.13Å; A60-L78 HydrophobicContact CB-CD2 4.14Å; A60-L78 HydrophobicContact CB-CG 4.05Å; F76-L78 HydrophobicContact CE2-CD2 3.89Å; L78-I89 HydrophobicContact CD1-CD1 4.43Å; L78-I89 HydrophobicContact CD1-CG2 4.42Å; L78-Y94 HydrophobicContact CD2-CD2 4.07Å
79	M	94.6	Very high	94.1	Very high	82 Å²	82	65.2 Å²	65.2	40%	0.404	33%	0.331	S	S	.	.			trans	-86.3	136.8	171	-172.3	164.4	-67.3	0	0	109.5	D90 Y93	M79-D90 HydrophobicContact CB-CB 4.06Å; M79-D90 HydrophobicContact CG-CB 4.24Å; M79-D90 PolarHBondContact O-N 3.49Å; M79-Y93 HydrophobicContact CB-CD1 3.82Å; M79-Y93 HydrophobicContact CB-CD2 4.02Å; M79-Y93 HydrophobicContact CB-CE1 4.25Å; M79-Y93 HydrophobicContact CB-CE2 4.41Å; M79-Y93 HydrophobicContact CB-CG 3.7Å; M79-Y93 HydrophobicContact CE-CD2 4.06Å; M79-Y93 HydrophobicContact CE-CE2 3.94Å; M79-Y93 HydrophobicContact SD-CD2 4.25Å
80	S	93.1	Very high	94.4	Very high	49 Å²	49	62.3 Å²	62.3	34%	0.343	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	148.8	177.8	64.4	0	0	0	0	111.6	H88	S80-H88 CarbonylContact C-O 3.48Å; S80-H88 WeakPolarHBondContact CA-O 3.3Å; S80-H88 WeakPolarHBondContact CB-O 3.34Å
81	H	92.8	Very high	94.3	Very high	93 Å²	93	64.2 Å²	64.2	43%	0.431	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	141.4	176.5	-57.8	-63.9	0	0	0	110.5	H88 D90	H81-H88 PolarHBondContact N-O 2.56Å; H81-H88 PolarHBondContact O-N 2.63Å; H81-D90 IonicContact NE2-OD2 3.83Å
82	T	91.3	Very high	94.3	Very high	102 Å²	102	67.5 Å²	67.5	63%	0.626	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	115.1	171	-52.4	0	0	0	0	109.1	K86	T82-K86 CarbonylContact C-O 3.59Å; T82-K86 VanDerWaalsContact CA-O 3.32Å; T82-K86 WeakPolarHBondContact CA-O 3.07Å
83	I	90.6	Very high	94.2	Very high	92 Å²	92	70.7 Å²	70.7	47%	0.472	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	127.4	175.3	-53.6	173.8	0	0	0	106.4	E85 K86	I83-E85 VanDerWaalsContact C-N 3.29Å; I83-E85 PolarHBondContact O-N 2.85Å; I83-K86 PolarHBondContact N-O 2.81Å; I83-K86 PolarHBondContact O-N 2.76Å; I83-K86 VanDerWaalsContact O-O 3.11Å
84	D	87.6	Confident	94.2	Very high	147 Å²	147	69 Å²	69	79%	0.786	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	45.6	-179.1	-56.7	-29.7	0	0	0	113.8	K86	D84-K86 PolarHBondContact O-N 2.78Å
85	E	88	Confident	94.2	Very high	191 Å²	191	72.8 Å²	72.8	89%	0.893	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	7.1	-177.2	-53.7	-175.3	159.7	0	0	115.2	I83	I83-E85 VanDerWaalsContact C-N 3.29Å; I83-E85 PolarHBondContact O-N 2.85Å
86	K	90.4	Very high	94.1	Very high	121 Å²	121	76 Å²	76	53%	0.526	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	140.4	176.7	-67.7	178.6	-176.8	172	0	111.2	T82 I83 D84 H88	T82-K86 CarbonylContact C-O 3.59Å; T82-K86 VanDerWaalsContact CA-O 3.32Å; T82-K86 WeakPolarHBondContact CA-O 3.07Å; I83-K86 PolarHBondContact N-O 2.81Å; I83-K86 PolarHBondContact O-N 2.76Å; I83-K86 VanDerWaalsContact O-O 3.11Å; D84-K86 PolarHBondContact O-N 2.78Å; K86-H88 PolarHBondContact O-CD2 3.02Å
87	V	93.9	Very high	94	Very high	26 Å²	26	77.4 Å²	77.4	16%	0.158	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	123	179.5	-177.1	0	0	0	0	109.6	I58 H126 I127 Q130	I58-V87 HydrophobicContact CD1-CG1 3.6Å; V87-H126 PolarHBondContact O-CD2 2.88Å; V87-H126 PolarHBondContact O-NE2 2.87Å; V87-I127 HydrophobicContact CB-CD1 4.2Å; V87-I127 HydrophobicContact CB-CG1 4.24Å; V87-I127 HydrophobicContact CG1-CD1 4.3Å; V87-I127 HydrophobicContact CG1-CG1 4.44Å; V87-Q130 PolarHBondContact O-NE2 2.71Å
88	H	95	Very high	93.9	Very high	64 Å²	64	76.1 Å²	76.1	30%	0.296	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	126.9	176.9	-70.5	-83.4	0	0	0	110.5	S80 H81 K86 H126 Q130	S80-H88 CarbonylContact C-O 3.48Å; S80-H88 WeakPolarHBondContact CA-O 3.3Å; S80-H88 WeakPolarHBondContact CB-O 3.34Å; H81-H88 PolarHBondContact N-O 2.56Å; H81-H88 PolarHBondContact O-N 2.63Å; K86-H88 PolarHBondContact O-CD2 3.02Å; H88-H126 AromaticContact CE1-NE2 3.81Å; H88-Q130 VanDerWaalsContact CA-OE1 3.27Å
89	I	95.8	Very high	93.9	Very high	14 Å²	14	81.9 Å²	81.9	7%	0.072	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	131.9	173.8	-64.3	177.5	0	0	0	108.7	L78 K91 I127 V131	L78-I89 HydrophobicContact CD1-CD1 4.43Å; L78-I89 HydrophobicContact CD1-CG2 4.42Å; I89-K91 PolarHBondContact O-N 2.82Å; I89-I127 HydrophobicContact CD1-CG2 3.62Å; I89-I127 HydrophobicContact CG1-CG2 4.14Å; I89-V131 HydrophobicContact CD1-CG2 3.54Å
90	D	96.4	Very high	93.9	Very high	35 Å²	35	82.9 Å²	82.9	19%	0.187	40%	0.404	C	S	.	.			trans	-73.9	104.6	168.7	-175.8	-24.9	0	0	0	109.1	M79 H81 E92 Y93 Y94	M79-D90 HydrophobicContact CB-CB 4.06Å; M79-D90 HydrophobicContact CG-CB 4.24Å; M79-D90 PolarHBondContact O-N 3.49Å; H81-D90 IonicContact NE2-OD2 3.83Å; D90-E92 PolarHBondContact OD1-N 2.81Å; D90-Y93 VanDerWaalsContact CG-CB 3.48Å; D90-Y93 WeakPolarHBondContact OD1-CB 3.43Å; D90-Y93 PolarHBondContact OD1-N 2.84Å; D90-Y94 PolarHBondContact O-N 2.81Å
91	K	94.9	Very high	93.9	Very high	50 Å²	50	81.4 Å²	81.4	22%	0.217	39%	0.392	C	S	.	.	H	α-helix	trans	-75.7	-35.5	-176.1	-65.3	-174.7	-177.7	-178.7	0	111.9	I89 Y93 Y94 Y95 E133	I89-K91 PolarHBondContact O-N 2.82Å; K91-Y93 VanDerWaalsContact C-N 3.28Å; K91-Y93 PolarHBondContact O-N 2.93Å; K91-Y94 WeakPolarHBondContact O-CB 3.46Å; K91-Y94 PolarHBondContact O-N 2.83Å; K91-Y94 VanDerWaalsContact O-N 3.13Å; K91-Y95 HydrophobicContact CB-CD2 4.46Å; K91-Y95 HydrophobicContact CB-CE2 4.22Å; K91-Y95 WeakPolarHBondContact O-CD2 3.21Å; K91-Y95 PolarHBondContact O-N 2.91Å; K91-E133 IonicContact NZ-OE2 3.58Å; K91-E133 PolarHBondContact NZ-OE2 3.02Å
92	E	95.8	Very high	94	Very high	138 Å²	138	79.8 Å²	79.8	65%	0.645	38%	0.384	S	S	*	.	H	α-helix	trans	-61.3	-40	174.9	-71.6	74.2	-166.6	0	0	111	D90 Y95 T96	D90-E92 PolarHBondContact OD1-N 2.81Å; E92-Y95 PolarHBondContact O-N 2.94Å; E92-T96 WeakPolarHBondContact O-CB 3.26Å; E92-T96 PolarHBondContact O-N 2.83Å; E92-T96 PolarHBondContact O-OG1 3.14Å
93	Y	95.9	Very high	94.3	Very high	69 Å²	69	81.1 Å²	81.1	27%	0.271	38%	0.383	S	S	.	.	H	α-helix	trans	-60.8	-45.5	171.4	-176.5	-89.2	0	0	0	111.5	M79 D90 K91 T96 K97	M79-Y93 HydrophobicContact CB-CD1 3.82Å; M79-Y93 HydrophobicContact CB-CD2 4.02Å; M79-Y93 HydrophobicContact CB-CE1 4.25Å; M79-Y93 HydrophobicContact CB-CE2 4.41Å; M79-Y93 HydrophobicContact CB-CG 3.7Å; M79-Y93 HydrophobicContact CE-CD2 4.06Å; M79-Y93 HydrophobicContact CE-CE2 3.94Å; M79-Y93 HydrophobicContact SD-CD2 4.25Å; D90-Y93 VanDerWaalsContact CG-CB 3.48Å; D90-Y93 WeakPolarHBondContact OD1-CB 3.43Å; D90-Y93 PolarHBondContact OD1-N 2.84Å; K91-Y93 VanDerWaalsContact C-N 3.28Å; K91-Y93 PolarHBondContact O-N 2.93Å; Y93-T96 PolarHBondContact O-N 2.71Å; Y93-K97 HydrophobicContact CD1-CG 4.05Å; Y93-K97 HydrophobicContact CE1-CD 4.4Å; Y93-K97 HydrophobicContact CE1-CG 3.59Å; Y93-K97 WeakPolarHBondContact O-CB 3.4Å; Y93-K97 WeakPolarHBondContact O-CG 3.17Å; Y93-K97 PolarHBondContact O-N 3.02Å; Y93-K97 WeakPolarHBondContact OH-CE 3.13Å
94	Y	96.4	Very high	94.5	Very high	1 Å²	1	81.9 Å²	81.9	0%	0.004	39%	0.391	C	S	.	.	H	α-helix	trans	-58.1	-52	175.4	166.5	-93.7	0	0	0	111.9	F76 L78 D90 K91 T96 K97 E98 F110 I134	F76-Y94 HydrophobicContact CZ-CD2 4.28Å; F76-Y94 HydrophobicContact CZ-CE2 4.33Å; L78-Y94 HydrophobicContact CD2-CD2 4.07Å; D90-Y94 PolarHBondContact O-N 2.81Å; K91-Y94 WeakPolarHBondContact O-CB 3.46Å; K91-Y94 PolarHBondContact O-N 2.83Å; K91-Y94 VanDerWaalsContact O-N 3.13Å; Y94-T96 VanDerWaalsContact C-N 3.28Å; Y94-T96 PolarHBondContact O-N 3.43Å; Y94-K97 CarbonylContact O-C 3.57Å; Y94-K97 WeakPolarHBondContact O-CA 3.35Å; Y94-K97 WeakPolarHBondContact O-CB 3.5Å; Y94-K97 PolarHBondContact O-N 2.9Å; Y94-E98 HydrophobicContact CE1-CB 4.29Å; Y94-E98 WeakPolarHBondContact O-CB 3.25Å; Y94-E98 PolarHBondContact O-N 3.05Å; Y94-E98 PolarHBondContact OH-OE1 2.84Å; Y94-F110 HydrophobicContact CD2-CE2 4.39Å; Y94-F110 HydrophobicContact CE2-CB 4.24Å; Y94-F110 AromaticContact CE2-CD1 3.9Å; Y94-F110 HydrophobicContact CE2-CD1 3.9Å; Y94-F110 AromaticContact CE2-CD2 3.6Å; Y94-F110 HydrophobicContact CE2-CD2 3.6Å; Y94-F110 HydrophobicContact CE2-CE1 4.1Å; Y94-F110 AromaticContact CE2-CE2 3.78Å; Y94-F110 HydrophobicContact CE2-CE2 3.78Å; Y94-F110 AromaticContact CE2-CG 3.66Å; Y94-F110 HydrophobicContact CE2-CG 3.66Å; Y94-F110 HydrophobicContact CE2-CZ 4.04Å; Y94-F110 AromaticContact CZ-CD1 3.77Å; Y94-F110 AromaticContact CZ-CG 3.74Å; Y94-F110 WeakPolarHBondContact OH-CB 3.14Å; Y94-F110 WeakPolarHBondContact OH-CD1 3.41Å; Y94-F110 WeakPolarHBondContact OH-CG 3.21Å; Y94-I134 HydrophobicContact CD1-CD1 3.99Å; Y94-I134 HydrophobicContact CD1-CG2 4.04Å; Y94-I134 HydrophobicContact CE1-CD1 4.41Å; Y94-I134 HydrophobicContact CE1-CG2 3.45Å; Y94-I134 VanDerWaalsContact CE1-CG2 3.45Å; Y94-I134 HydrophobicContact CG-CD1 4.22Å
95	Y	95.6	Very high	94.8	Very high	112 Å²	112	78.7 Å²	78.7	44%	0.439	37%	0.371	S	S	.	.	H	α-helix	trans	-62.4	-36.6	-178.4	-71.8	-61.1	0	0	0	112.3	K91 E92 E98 E99	K91-Y95 HydrophobicContact CB-CD2 4.46Å; K91-Y95 HydrophobicContact CB-CE2 4.22Å; K91-Y95 WeakPolarHBondContact O-CD2 3.21Å; K91-Y95 PolarHBondContact O-N 2.91Å; E92-Y95 PolarHBondContact O-N 2.94Å; Y95-E98 PolarHBondContact O-N 2.77Å; Y95-E99 PolarHBondContact O-N 3.26Å
96	T	96.6	Very high	95.1	Very high	76 Å²	76	77 Å²	77	47%	0.466	36%	0.36	S	S	.	.	H	α-helix	trans	-63.2	-42.7	173	-56.3	0	0	0	0	111.2	E92 Y93 Y94 E98 Q100	E92-T96 WeakPolarHBondContact O-CB 3.26Å; E92-T96 PolarHBondContact O-N 2.83Å; E92-T96 PolarHBondContact O-OG1 3.14Å; Y93-T96 PolarHBondContact O-N 2.71Å; Y94-T96 VanDerWaalsContact C-N 3.28Å; Y94-T96 PolarHBondContact O-N 3.43Å; T96-E98 VanDerWaalsContact C-N 3.35Å; T96-Q100 VanDerWaalsContact O-CG 3.32Å; T96-Q100 WeakPolarHBondContact O-CG 3.35Å; T96-Q100 PolarHBondContact O-N 3.46Å
97	K	95.4	Very high	95.2	Very high	65 Å²	65	78 Å²	78	28%	0.283	37%	0.367	S	S	.	.	H	α-helix	trans	-67.3	-36.3	176.1	-80.9	-71.7	176.8	-166.1	0	112.5	F76 Y93 Y94 Q100 F101	F76-K97 HydrophobicContact CD2-CB 4.36Å; F76-K97 HydrophobicContact CD2-CD 4.49Å; F76-K97 HydrophobicContact CD2-CG 4.39Å; F76-K97 HydrophobicContact CE2-CB 3.68Å; F76-K97 HydrophobicContact CE2-CG 4.1Å; F76-K97 HydrophobicContact CZ-CB 4.1Å; Y93-K97 HydrophobicContact CD1-CG 4.05Å; Y93-K97 HydrophobicContact CE1-CD 4.4Å; Y93-K97 HydrophobicContact CE1-CG 3.59Å; Y93-K97 WeakPolarHBondContact O-CB 3.4Å; Y93-K97 WeakPolarHBondContact O-CG 3.17Å; Y93-K97 PolarHBondContact O-N 3.02Å; Y93-K97 WeakPolarHBondContact OH-CE 3.13Å; Y94-K97 CarbonylContact O-C 3.57Å; Y94-K97 WeakPolarHBondContact O-CA 3.35Å; Y94-K97 WeakPolarHBondContact O-CB 3.5Å; Y94-K97 PolarHBondContact O-N 2.9Å; K97-Q100 WeakPolarHBondContact O-CB 3.36Å; K97-Q100 PolarHBondContact O-N 2.92Å; K97-F101 WeakPolarHBondContact O-CD1 3.4Å; K97-F101 PolarHBondContact O-N 3.32Å
98	E	95.5	Very high	95.3	Very high	55 Å²	55	77.8 Å²	77.8	26%	0.257	37%	0.365	S	S	.	.	H	α-helix	trans	-59.4	-50.9	175.4	-176.9	177.5	-126.6	0	0	111.4	Y94 Y95 T96 Q100 F101 K102	Y94-E98 HydrophobicContact CE1-CB 4.29Å; Y94-E98 WeakPolarHBondContact O-CB 3.25Å; Y94-E98 PolarHBondContact O-N 3.05Å; Y94-E98 PolarHBondContact OH-OE1 2.84Å; Y95-E98 PolarHBondContact O-N 2.77Å; T96-E98 VanDerWaalsContact C-N 3.35Å; E98-Q100 PolarHBondContact O-N 3.27Å; E98-F101 HydrophobicContact CB-CE1 3.93Å; E98-F101 HydrophobicContact CB-CZ 4.38Å; E98-F101 HydrophobicContact CG-CE1 4.01Å; E98-F101 HydrophobicContact CG-CZ 3.94Å; E98-F101 PolarHBondContact O-N 3.22Å; E98-K102 HydrophobicContact CG-CG 4.22Å; E98-K102 VanDerWaalsContact O-CB 3.27Å; E98-K102 WeakPolarHBondContact O-CB 3.39Å; E98-K102 VanDerWaalsContact O-CG 3.25Å; E98-K102 WeakPolarHBondContact O-CG 3.21Å; E98-K102 PolarHBondContact O-N 3.05Å
99	E	95.7	Very high	95.3	Very high	137 Å²	137	80 Å²	80	64%	0.64	38%	0.375	S	S	*	.	H	α-helix	trans	-57.5	-40.5	176.3	-171.3	176.9	-170.6	0	0	111.6	Y95 Q103	Y95-E99 PolarHBondContact O-N 3.26Å; E99-Q103 WeakPolarHBondContact O-CG 2.9Å; E99-Q103 PolarHBondContact O-N 2.95Å
100	Q	95.1	Very high	95.4	Very high	103 Å²	103	79.9 Å²	79.9	48%	0.481	37%	0.374	S	S	.	.	H	α-helix	trans	-64.9	-52.4	177.8	-70.8	172.1	5.7	0	0	112.6	T96 K97 E98 K102 Q103	T96-Q100 VanDerWaalsContact O-CG 3.32Å; T96-Q100 WeakPolarHBondContact O-CG 3.35Å; T96-Q100 PolarHBondContact O-N 3.46Å; K97-Q100 WeakPolarHBondContact O-CB 3.36Å; K97-Q100 PolarHBondContact O-N 2.92Å; E98-Q100 PolarHBondContact O-N 3.27Å; Q100-K102 VanDerWaalsContact C-N 3.31Å; Q100-K102 PolarHBondContact O-N 3.33Å; Q100-Q103 WeakPolarHBondContact O-CB 3.36Å; Q100-Q103 PolarHBondContact O-N 3.25Å
101	F	93.2	Very high	95.5	Very high	18 Å²	18	78.6 Å²	78.6	8%	0.079	37%	0.367	C	S	.	.	H	α-helix	trans	-71	-31.3	-176.1	81	-114.9	0	0	0	111.3	I62 F76 K97 E98 Q103 V104 F105	I62-F101 HydrophobicContact CD1-CD2 4.19Å; I62-F101 HydrophobicContact CD1-CG 4.35Å; I62-F101 HydrophobicContact CG2-CE1 4.08Å; I62-F101 HydrophobicContact CG2-CE2 4.38Å; I62-F101 HydrophobicContact CG2-CZ 3.95Å; F76-F101 HydrophobicContact CD1-CD1 4.39Å; F76-F101 AromaticContact CE1-CD1 3.56Å; F76-F101 HydrophobicContact CE1-CD1 3.56Å; F76-F101 AromaticContact CE1-CE1 3.62Å; F76-F101 HydrophobicContact CE1-CE1 3.62Å; F76-F101 AromaticContact CZ-CD1 3.97Å; F76-F101 HydrophobicContact CZ-CD1 3.97Å; F76-F101 AromaticContact CZ-CE1 3.89Å; F76-F101 HydrophobicContact CZ-CE1 3.89Å; K97-F101 WeakPolarHBondContact O-CD1 3.4Å; K97-F101 PolarHBondContact O-N 3.32Å; E98-F101 HydrophobicContact CB-CE1 3.93Å; E98-F101 HydrophobicContact CB-CZ 4.38Å; E98-F101 HydrophobicContact CG-CE1 4.01Å; E98-F101 HydrophobicContact CG-CZ 3.94Å; E98-F101 PolarHBondContact O-N 3.22Å; F101-Q103 PolarHBondContact O-N 3.23Å; F101-V104 WeakPolarHBondContact O-CG2 3.27Å; F101-V104 PolarHBondContact O-N 3.42Å; F101-V104 VanDerWaalsContact O-N 3.1Å; F101-F105 HydrophobicContact CB-CD2 4.46Å; F101-F105 PolarHBondContact O-N 3.01Å
102	K	95.8	Very high	95.6	Very high	59 Å²	59	76.2 Å²	76.2	26%	0.257	36%	0.357	S	S	.	.	H	α-helix	trans	-63.9	-20.2	175.4	-76.2	-69.3	-163.8	173.9	0	113.1	E98 Q100 V104 K106 M108	E98-K102 HydrophobicContact CG-CG 4.22Å; E98-K102 VanDerWaalsContact O-CB 3.27Å; E98-K102 WeakPolarHBondContact O-CB 3.39Å; E98-K102 VanDerWaalsContact O-CG 3.25Å; E98-K102 WeakPolarHBondContact O-CG 3.21Å; E98-K102 PolarHBondContact O-N 3.05Å; Q100-K102 VanDerWaalsContact C-N 3.31Å; Q100-K102 PolarHBondContact O-N 3.33Å; K102-V104 VanDerWaalsContact C-N 3.33Å; K102-K106 PolarHBondContact NZ-O 3.34Å; K102-K106 WeakPolarHBondContact O-CG 3.2Å; K102-M108 WeakPolarHBondContact CE-O 3.42Å; K102-M108 PolarHBondContact NZ-O 2.89Å
103	Q	95.9	Very high	95.7	Very high	131 Å²	131	69.6 Å²	69.6	61%	0.612	33%	0.326	S	S	*	.	H	α-helix	trans	-65.1	-37.3	172.3	-64	-56.9	-34.2	0	0	112.6	E99 Q100 F101	E99-Q103 WeakPolarHBondContact O-CG 2.9Å; E99-Q103 PolarHBondContact O-N 2.95Å; Q100-Q103 WeakPolarHBondContact O-CB 3.36Å; Q100-Q103 PolarHBondContact O-N 3.25Å; F101-Q103 PolarHBondContact O-N 3.23Å
104	V	95.6	Very high	95.9	Very high	107 Å²	107	66.4 Å²	66.4	65%	0.648	31%	0.313	S	S	*	.	H	α-helix	trans	-100.8	-32.8	-176	-69.5	0	0	0	0	112.7	F101 K102	F101-V104 WeakPolarHBondContact O-CG2 3.27Å; F101-V104 PolarHBondContact O-N 3.42Å; F101-V104 VanDerWaalsContact O-N 3.1Å; K102-V104 VanDerWaalsContact C-N 3.33Å
105	F	93.9	Very high	96	Very high	80 Å²	80	66.4 Å²	66.4	35%	0.351	31%	0.313	S	S	.	.			trans	-121.8	64.8	-176.6	-57	-59.7	0	0	0	110.7	F101 E107 M108	F101-F105 HydrophobicContact CB-CD2 4.46Å; F101-F105 PolarHBondContact O-N 3.01Å; F105-E107 VanDerWaalsContact C-N 3.26Å; F105-E107 PolarHBondContact O-N 2.82Å; F105-M108 HydrophobicContact CB-CB 3.97Å; F105-M108 HydrophobicContact CB-CG 3.92Å; F105-M108 HydrophobicContact CB-SD 3.76Å; F105-M108 HydrophobicContact CD1-CE 3.88Å; F105-M108 HydrophobicContact CD1-SD 3.99Å; F105-M108 HydrophobicContact CD2-SD 4.36Å; F105-M108 HydrophobicContact CE1-CE 4.35Å; F105-M108 HydrophobicContact CG-CE 4.32Å; F105-M108 HydrophobicContact CG-SD 3.79Å; F105-M108 PolarHBondContact O-N 3.18Å; F105-M108 VanDerWaalsContact O-N 3.14Å
106	K	94.1	Very high	96.1	Very high	155 Å²	155	61.4 Å²	61.4	67%	0.674	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-37.2	-176.1	-70	178.1	-179.1	-178.1	0	113.7	K102	K102-K106 PolarHBondContact NZ-O 3.34Å; K102-K106 WeakPolarHBondContact O-CG 3.2Å
107	E	92.7	Very high	96	Very high	142 Å²	142	58.9 Å²	58.9	66%	0.664	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-10.9	-177.8	-61.6	-179.1	-177.2	0	0	113.6	K64 F105	K64-E107 IonicContact NZ-OE2 2.84Å; K64-E107 PolarHBondContact NZ-OE2 3.49Å; F105-E107 VanDerWaalsContact C-N 3.26Å; F105-E107 PolarHBondContact O-N 2.82Å
108	M	95	Very high	95.8	Very high	23 Å²	23	57.6 Å²	57.6	11%	0.113	29%	0.289	C	S	.	.			trans	-88.6	138.2	179.3	-67.1	-175.4	-175.7	0	0	110.4	I62 G63 M73 K102 F105	I62-M108 HydrophobicContact CD1-SD 4.07Å; I62-M108 HydrophobicContact CG1-SD 4.3Å; G63-M108 CarbonylContact O-C 3.58Å; G63-M108 VanDerWaalsContact O-CA 3.27Å; G63-M108 WeakPolarHBondContact O-CA 3.49Å; M73-M108 HydrophobicContact CB-CE 4.07Å; M73-M108 HydrophobicContact CE-CE 4.28Å; M73-M108 HydrophobicContact SD-CE 3.87Å; K102-M108 WeakPolarHBondContact CE-O 3.42Å; K102-M108 PolarHBondContact NZ-O 2.89Å; F105-M108 HydrophobicContact CB-CB 3.97Å; F105-M108 HydrophobicContact CB-CG 3.92Å; F105-M108 HydrophobicContact CB-SD 3.76Å; F105-M108 HydrophobicContact CD1-CE 3.88Å; F105-M108 HydrophobicContact CD1-SD 3.99Å; F105-M108 HydrophobicContact CD2-SD 4.36Å; F105-M108 HydrophobicContact CE1-CE 4.35Å; F105-M108 HydrophobicContact CG-CE 4.32Å; F105-M108 HydrophobicContact CG-SD 3.79Å; F105-M108 PolarHBondContact O-N 3.18Å; F105-M108 VanDerWaalsContact O-N 3.14Å
109	E	96.1	Very high	95.7	Very high	109 Å²	109	60.2 Å²	60.2	51%	0.509	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	163.1	176.8	-61.5	-169.7	159.3	0	0	110.6	I62 G63 L111	I62-E109 WeakPolarHBondContact CA-O 3.47Å; I62-E109 WeakPolarHBondContact CB-O 3.38Å; G63-E109 PolarHBondContact N-O 3.38Å; G63-E109 PolarHBondContact O-N 2.83Å; E109-L111 PolarHBondContact O-N 2.97Å
110	F	97.7	Very high	95.7	Very high	13 Å²	13	54.3 Å²	54.3	6%	0.057	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	119.1	171.9	-178.5	-123.8	0	0	0	109.3	A60 L61 I62 Y94 G112 V131 I134 I135	A60-F110 HydrophobicContact CB-CD2 4.02Å; A60-F110 HydrophobicContact CB-CE2 3.52Å; L61-F110 WeakPolarHBondContact O-CD2 3.47Å; I62-F110 HydrophobicContact CG2-CD2 4.45Å; Y94-F110 HydrophobicContact CD2-CE2 4.39Å; Y94-F110 HydrophobicContact CE2-CB 4.24Å; Y94-F110 AromaticContact CE2-CD1 3.9Å; Y94-F110 HydrophobicContact CE2-CD1 3.9Å; Y94-F110 AromaticContact CE2-CD2 3.6Å; Y94-F110 HydrophobicContact CE2-CD2 3.6Å; Y94-F110 HydrophobicContact CE2-CE1 4.1Å; Y94-F110 AromaticContact CE2-CE2 3.78Å; Y94-F110 HydrophobicContact CE2-CE2 3.78Å; Y94-F110 AromaticContact CE2-CG 3.66Å; Y94-F110 HydrophobicContact CE2-CG 3.66Å; Y94-F110 HydrophobicContact CE2-CZ 4.04Å; Y94-F110 AromaticContact CZ-CD1 3.77Å; Y94-F110 AromaticContact CZ-CG 3.74Å; Y94-F110 WeakPolarHBondContact OH-CB 3.14Å; Y94-F110 WeakPolarHBondContact OH-CD1 3.41Å; Y94-F110 WeakPolarHBondContact OH-CG 3.21Å; F110-G112 WeakPolarHBondContact CE2-O 3.48Å; F110-G112 WeakPolarHBondContact CZ-O 3.48Å; F110-V131 HydrophobicContact CE1-CG1 3.72Å; F110-V131 HydrophobicContact CZ-CG1 3.79Å; F110-I134 HydrophobicContact CD1-CG2 3.95Å; F110-I134 HydrophobicContact CE1-CB 4.23Å; F110-I134 HydrophobicContact CE1-CD1 4.4Å; F110-I134 HydrophobicContact CE1-CG2 3.97Å; F110-I135 HydrophobicContact CD1-CD1 3.63Å; F110-I135 HydrophobicContact CD1-CG1 3.92Å; F110-I135 HydrophobicContact CD1-CG2 3.83Å; F110-I135 HydrophobicContact CE1-CD1 3.91Å; F110-I135 HydrophobicContact CE1-CG1 4Å; F110-I135 HydrophobicContact CG-CD1 4.34Å; F110-I135 WeakPolarHBondContact O-CD1 3.17Å
111	L	97.8	Very high	95.6	Very high	7 Å²	7	52.6 Å²	52.6	4%	0.037	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	-20.8	-173.3	-62.1	178.6	0	0	0	112.4	L61 Q65 I70 E71 V72 E109 L139	L61-L111 PolarHBondContact O-N 3.22Å; Q65-L111 HydrophobicContact CB-CD2 4.29Å; I70-L111 HydrophobicContact CG2-CB 4.44Å; I70-L111 HydrophobicContact CG2-CD1 3.64Å; I70-L111 HydrophobicContact CG2-CD2 4.03Å; I70-L111 HydrophobicContact CG2-CG 4.26Å; E71-L111 WeakPolarHBondContact O-CD1 3.46Å; V72-L111 HydrophobicContact CG2-CD1 4.18Å; E109-L111 PolarHBondContact O-N 2.97Å; L111-L139 PolarHBondContact O-N 3.47Å
112	G	98.1	Very high	95.6	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	156.8	-157.4	-173.3	0	0	0	0	0	112.6	L61 F110 L139	L61-G112 PolarHBondContact N-O 3.08Å; F110-G112 WeakPolarHBondContact CE2-O 3.48Å; F110-G112 WeakPolarHBondContact CZ-O 3.48Å; G112-L139 CarbonylContact C-O 3.59Å; G112-L139 WeakPolarHBondContact CA-O 3.4Å
113	W	98.6	Very high	95.5	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	159.1	-172.1	72.3	-67.1	0	0	0	111.4	I58 G59 L61 T115 D124 I127 H128 V131 L139 F140 L141	I58-W113 HydrophobicContact CG2-CE3 4.09Å; I58-W113 HydrophobicContact CG2-CZ3 4.45Å; G59-W113 CarbonylContact O-C 3.44Å; G59-W113 WeakPolarHBondContact O-CA 3.08Å; G59-W113 WeakPolarHBondContact O-CB 3.25Å; L61-W113 WeakPolarHBondContact CD1-O 3.44Å; W113-T115 HydrophobicContact CH2-CG2 4.2Å; W113-T115 HydrophobicContact CZ3-CG2 3.96Å; W113-D124 HydrophobicContact CH2-CB 4.11Å; W113-D124 HydrophobicContact CZ2-CB 4.31Å; W113-I127 HydrophobicContact CD2-CG2 4.05Å; W113-I127 HydrophobicContact CE3-CG2 3.69Å; W113-I127 HydrophobicContact CH2-CB 3.7Å; W113-I127 HydrophobicContact CH2-CD1 4.08Å; W113-I127 HydrophobicContact CH2-CG2 3.62Å; W113-I127 HydrophobicContact CZ2-CB 4.08Å; W113-I127 HydrophobicContact CZ2-CG2 3.99Å; W113-I127 HydrophobicContact CZ3-CB 4Å; W113-I127 HydrophobicContact CZ3-CD1 4.07Å; W113-I127 HydrophobicContact CZ3-CG2 3.45Å; W113-I127 VanDerWaalsContact CZ3-CG2 3.45Å; W113-H128 AromaticContact CD1-ND1 3.72Å; W113-H128 HydrophobicContact CZ2-CB 4.1Å; W113-H128 AromaticContact NE1-CG 3.86Å; W113-H128 AromaticContact NE1-ND1 3.02Å; W113-H128 PolarHBondContact NE1-ND1 2.81Å; W113-V131 HydrophobicContact CB-CG2 4.11Å; W113-V131 HydrophobicContact CD2-CG2 4.4Å; W113-V131 HydrophobicContact CG-CG2 3.86Å; W113-L139 PolarHBondContact N-O 2.76Å; W113-F140 AromaticContact CD2-CD2 3.86Å; W113-F140 HydrophobicContact CD2-CD2 3.86Å; W113-F140 HydrophobicContact CD2-CE2 4.2Å; W113-F140 AromaticContact CE2-CD2 3.28Å; W113-F140 AromaticContact CE2-CE2 3.7Å; W113-F140 AromaticContact CE2-CG 3.95Å; W113-F140 HydrophobicContact CE3-CD2 4.33Å; W113-F140 HydrophobicContact CE3-CE2 4.23Å; W113-F140 HydrophobicContact CG-CD2 4.46Å; W113-F140 AromaticContact CH2-CD2 3.86Å; W113-F140 HydrophobicContact CH2-CD2 3.86Å; W113-F140 AromaticContact CH2-CE2 3.33Å; W113-F140 HydrophobicContact CH2-CE2 3.33Å; W113-F140 AromaticContact CH2-CZ 3.86Å; W113-F140 HydrophobicContact CH2-CZ 3.86Å; W113-F140 HydrophobicContact CZ2-CD1 4.44Å; W113-F140 AromaticContact CZ2-CD2 3.29Å; W113-F140 HydrophobicContact CZ2-CD2 3.29Å; W113-F140 HydrophobicContact CZ2-CE1 4.41Å; W113-F140 AromaticContact CZ2-CE2 3.26Å; W113-F140 HydrophobicContact CZ2-CE2 3.26Å; W113-F140 AromaticContact CZ2-CG 3.91Å; W113-F140 HydrophobicContact CZ2-CG 3.91Å; W113-F140 AromaticContact CZ2-CZ 3.84Å; W113-F140 HydrophobicContact CZ2-CZ 3.84Å; W113-F140 HydrophobicContact CZ3-CD2 4.34Å; W113-F140 AromaticContact CZ3-CE2 3.84Å; W113-F140 HydrophobicContact CZ3-CE2 3.84Å; W113-F140 AromaticContact NE1-CD2 3.51Å; W113-F140 AromaticContact NE1-CG 3.81Å; W113-F140 WeakPolarHBondContact O-CA 3.43Å; W113-L141 PolarHBondContact O-N 3.1Å
114	Y	98.7	Very high	95.6	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.008	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	156.1	174.5	71.6	-96.6	0	0	0	112.4	I40 H43 V57 I58 G59 L61 L141	I40-Y114 HydrophobicContact CB-CD2 4.26Å; I40-Y114 HydrophobicContact CB-CE2 4.21Å; I40-Y114 HydrophobicContact CD1-CD1 4.14Å; I40-Y114 HydrophobicContact CD1-CD2 3.88Å; I40-Y114 HydrophobicContact CD1-CE2 4.49Å; I40-Y114 HydrophobicContact CD1-CG 3.68Å; I40-Y114 HydrophobicContact CG1-CD1 3.99Å; I40-Y114 HydrophobicContact CG1-CD2 3.55Å; I40-Y114 HydrophobicContact CG1-CE1 4.08Å; I40-Y114 HydrophobicContact CG1-CE2 3.66Å; I40-Y114 HydrophobicContact CG1-CG 3.72Å; I40-Y114 HydrophobicContact CG2-CD2 3.81Å; I40-Y114 HydrophobicContact CG2-CE2 3.95Å; H43-Y114 AromaticContact ND1-CE2 3.88Å; H43-Y114 AromaticContact ND1-CZ 3.83Å; H43-Y114 PolarHBondContact ND1-OH 3.41Å; V57-Y114 HydrophobicContact CG2-CE2 4.42Å; I58-Y114 WeakPolarHBondContact CA-O 3.27Å; G59-Y114 VanDerWaalsContact C-CD1 3.47Å; G59-Y114 VanDerWaalsContact CA-CZ 3.45Å; G59-Y114 PolarHBondContact N-O 2.89Å; G59-Y114 VanDerWaalsContact N-O 3.07Å; G59-Y114 WeakPolarHBondContact O-CD1 3.45Å; G59-Y114 PolarHBondContact O-N 2.83Å; L61-Y114 HydrophobicContact CD2-CD1 3.77Å; L61-Y114 HydrophobicContact CD2-CG 4.38Å; L61-Y114 HydrophobicContact CG-CD1 4.26Å; Y114-L141 CarbonylContact C-O 3.51Å; Y114-L141 WeakPolarHBondContact CA-O 3.13Å
115	T	98.4	Very high	95.6	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	174.7	165.1	-161	0	0	0	0	112.5	Q56 V57 W113 F140 L141 K142 L143	Q56-T115 WeakPolarHBondContact CG-OG1 3.43Å; Q56-T115 PolarHBondContact NE2-OG1 3.45Å; V57-T115 WeakPolarHBondContact O-CA 3.32Å; V57-T115 WeakPolarHBondContact O-CB 3.44Å; V57-T115 PolarHBondContact O-OG1 3.48Å; W113-T115 HydrophobicContact CH2-CG2 4.2Å; W113-T115 HydrophobicContact CZ3-CG2 3.96Å; T115-F140 HydrophobicContact CG2-CE2 3.65Å; T115-F140 HydrophobicContact CG2-CZ 3.87Å; T115-L141 PolarHBondContact N-O 3.21Å; T115-K142 HydrophobicContact CG2-CD 4.2Å; T115-K142 HydrophobicContact CG2-CG 4.01Å; T115-K142 WeakPolarHBondContact O-CA 3.2Å; T115-L143 PolarHBondContact O-N 3.35Å
116	T	97.3	Very high	95.7	Very high	7 Å²	7	43.9 Å²	43.9	4%	0.043	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	135.3	176.4	56	0	0	0	0	112.2	I40 W44 V57 L143	I40-T116 HydrophobicContact CG2-CG2 3.9Å; W44-T116 HydrophobicContact CB-CG2 4.17Å; W44-T116 HydrophobicContact CG-CG2 4.2Å; V57-T116 HydrophobicContact CG2-CG2 3.56Å; V57-T116 PolarHBondContact N-OG1 3.47Å; V57-T116 PolarHBondContact O-N 3.18Å; T116-L143 CarbonylContact C-O 3.53Å; T116-L143 WeakPolarHBondContact CA-O 3.48Å; T116-L143 HydrophobicContact CG2-CB 4.49Å; T116-L143 HydrophobicContact CG2-CD2 4.4Å
117	G	94.7	Very high	95.8	Very high	23 Å²	23	36.5 Å²	36.5	24%	0.237	21%	0.206	C	C	.	.	S	Bend	trans	166.2	-163.6	176.7	0	0	0	0	0	113.7	L143 N144	G117-L143 PolarHBondContact N-O 3.41Å; G117-N144 WeakPolarHBondContact O-CA 3.42Å; G117-N144 WeakPolarHBondContact O-CB 3.41Å
118	G	92.1	Very high	96.1	Very high	38 Å²	38	29.8 Å²	29.8	39%	0.392	17%	0.174	S	C	.	.	S	Bend	trans	-76.7	-152	171.1	0	0	0	0	0	112.6	K142	G118-K142 WeakPolarHBondContact O-CD 3.17Å; G118-K142 WeakPolarHBondContact O-CE 3.42Å; G118-K142 PolarHBondContact O-NZ 3.25Å
119	P	92.8	Very high	96.1	Very high	110 Å²	110	33.3 Å²	33.3	71%	0.714	19%	0.189	S	C	*	.	S	Bend	trans	-54.6	159.4	171.9	-25	35.3	0	0	0	112.9	K142	P119-K142 PolarHBondContact O-NZ 2.87Å
120	P	95.6	Very high	96.2	Very high	14 Å²	14	28.8 Å²	28.8	9%	0.091	17%	0.168	C	C	.	.			trans	-53.7	143.1	174.4	-27.6	37.1	0	0	0	112.5	V19 M20 D124 F140 Y157 F172	V19-P120 HydrophobicContact CG2-CB 3.97Å; V19-P120 WeakPolarHBondContact CG2-O 3.49Å; M20-P120 HydrophobicContact SD-CB 3.99Å; M20-P120 HydrophobicContact SD-CG 3.77Å; P120-D124 VanDerWaalsContact CA-OD2 3.25Å; P120-D124 WeakPolarHBondContact CA-OD2 3.44Å; P120-F140 HydrophobicContact CB-CE1 4.21Å; P120-F140 HydrophobicContact CG-CE1 4.21Å; P120-Y157 WeakPolarHBondContact CD-OH 3.1Å; P120-Y157 HydrophobicContact CG-CD1 4.36Å; P120-Y157 HydrophobicContact CG-CD2 4.22Å; P120-Y157 HydrophobicContact CG-CE1 3.82Å; P120-Y157 HydrophobicContact CG-CE2 3.66Å; P120-Y157 VanDerWaalsContact CG-CZ 3.42Å; P120-F172 HydrophobicContact CB-CD2 3.72Å; P120-F172 HydrophobicContact CB-CE2 4.18Å; P120-F172 HydrophobicContact CG-CD2 4.46Å
121	D	94.4	Very high	96.1	Very high	67 Å²	67	28.2 Å²	28.2	36%	0.358	17%	0.165	S	C	.	.			trans	-133	-178.1	179.4	67	40.4	0	0	0	112.6	S123 D124 I125 K142	D121-S123 VanDerWaalsContact C-N 3.27Å; D121-S123 PolarHBondContact O-N 3.29Å; D121-S123 WeakPolarHBondContact OD1-CA 3.3Å; D121-S123 VanDerWaalsContact OD1-CB 3.26Å; D121-S123 WeakPolarHBondContact OD1-CB 3.44Å; D121-S123 PolarHBondContact OD1-N 3.24Å; D121-S123 PolarHBondContact OD1-OG 3.46Å; D121-D124 PolarHBondContact N-OD2 3.22Å; D121-D124 WeakPolarHBondContact O-CB 3.46Å; D121-D124 PolarHBondContact O-N 3.32Å; D121-D124 PolarHBondContact OD1-N 3.32Å; D121-I125 PolarHBondContact O-N 2.99Å; D121-K142 IonicContact OD2-NZ 3.88Å
122	Q	92.8	Very high	96.1	Very high	109 Å²	109	29.5 Å²	29.5	51%	0.509	17%	0.174	S	C	.	.	H	α-helix	trans	-68.3	-26.7	-177.1	-166.9	59.9	62.1	0	0	113.2	D124 I125 H126	Q122-D124 VanDerWaalsContact C-N 3.33Å; Q122-I125 PolarHBondContact O-N 2.86Å; Q122-H126 PolarHBondContact O-N 3.47Å; Q122-H126 VanDerWaalsContact O-N 3.16Å
123	S	94.1	Very high	96	Very high	47 Å²	47	35.6 Å²	35.6	33%	0.329	20%	0.203	S	C	.	.	H	α-helix	trans	-69.6	-35.9	175	79.6	0	0	0	0	110.5	D121 H126 I127	D121-S123 VanDerWaalsContact C-N 3.27Å; D121-S123 PolarHBondContact O-N 3.29Å; D121-S123 WeakPolarHBondContact OD1-CA 3.3Å; D121-S123 VanDerWaalsContact OD1-CB 3.26Å; D121-S123 WeakPolarHBondContact OD1-CB 3.44Å; D121-S123 PolarHBondContact OD1-N 3.24Å; D121-S123 PolarHBondContact OD1-OG 3.46Å; S123-H126 WeakPolarHBondContact O-CB 3.47Å; S123-H126 PolarHBondContact O-N 3.05Å; S123-H126 VanDerWaalsContact O-N 3.15Å; S123-I127 WeakPolarHBondContact O-CG1 3.28Å; S123-I127 PolarHBondContact O-N 3.02Å
124	D	96.8	Very high	95.8	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-65	-41	174.3	-57.8	-47.7	0	0	0	111.9	W113 P120 D121 Q122 H126 I127 H128 F140 K142 F172	W113-D124 HydrophobicContact CH2-CB 4.11Å; W113-D124 HydrophobicContact CZ2-CB 4.31Å; P120-D124 VanDerWaalsContact CA-OD2 3.25Å; P120-D124 WeakPolarHBondContact CA-OD2 3.44Å; D121-D124 PolarHBondContact N-OD2 3.22Å; D121-D124 WeakPolarHBondContact O-CB 3.46Å; D121-D124 PolarHBondContact O-N 3.32Å; D121-D124 PolarHBondContact OD1-N 3.32Å; Q122-D124 VanDerWaalsContact C-N 3.33Å; D124-H126 VanDerWaalsContact C-N 3.26Å; D124-H126 PolarHBondContact O-N 3.31Å; D124-I127 PolarHBondContact O-N 3.41Å; D124-H128 WeakPolarHBondContact O-CB 3.39Å; D124-H128 PolarHBondContact O-N 3.38Å; D124-F140 HydrophobicContact CB-CE1 3.89Å; D124-F140 HydrophobicContact CB-CZ 3.76Å; D124-K142 IonicContact OD1-NZ 2.55Å; D124-K142 IonicContact OD2-NZ 3.56Å; D124-K142 PolarHBondContact OD2-NZ 2.92Å; D124-F172 HydrophobicContact CB-CE2 3.96Å; D124-F172 HydrophobicContact CB-CZ 4.25Å
125	I	95.9	Very high	95.6	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-59	-41.9	173.1	-69	175.9	0	0	0	110.3	V19 D121 Q122 H128 K129 M170 F172	V19-I125 HydrophobicContact CB-CD1 3.57Å; V19-I125 HydrophobicContact CB-CG1 4.26Å; V19-I125 HydrophobicContact CG1-CD1 3.4Å; V19-I125 VanDerWaalsContact CG1-CD1 3.4Å; V19-I125 HydrophobicContact CG1-CG1 4.28Å; D121-I125 PolarHBondContact O-N 2.99Å; Q122-I125 PolarHBondContact O-N 2.86Å; I125-H128 PolarHBondContact O-N 3.03Å; I125-K129 HydrophobicContact CG2-CD 4.33Å; I125-K129 HydrophobicContact CG2-CG 4.49Å; I125-K129 WeakPolarHBondContact O-CG 3.34Å; I125-K129 PolarHBondContact O-N 3.31Å; I125-M170 WeakPolarHBondContact CD1-O 3.5Å; I125-M170 HydrophobicContact CG2-CB 4.45Å; I125-M170 HydrophobicContact CG2-SD 4.5Å; I125-F172 HydrophobicContact CG1-CD2 4.28Å; I125-F172 HydrophobicContact CG1-CE2 3.67Å; I125-F172 HydrophobicContact CG1-CZ 4.25Å
126	H	95.7	Very high	95.2	Very high	51 Å²	51	48.2 Å²	48.2	24%	0.236	26%	0.264	C	S	.	.	H	α-helix	trans	-63.3	-43.7	-179.9	176.3	62.7	0	0	0	112.1	V87 H88 Q122 S123 D124 Q130	V87-H126 PolarHBondContact O-CD2 2.88Å; V87-H126 PolarHBondContact O-NE2 2.87Å; H88-H126 AromaticContact CE1-NE2 3.81Å; Q122-H126 PolarHBondContact O-N 3.47Å; Q122-H126 VanDerWaalsContact O-N 3.16Å; S123-H126 WeakPolarHBondContact O-CB 3.47Å; S123-H126 PolarHBondContact O-N 3.05Å; S123-H126 VanDerWaalsContact O-N 3.15Å; D124-H126 VanDerWaalsContact C-N 3.26Å; D124-H126 PolarHBondContact O-N 3.31Å; H126-Q130 PolarHBondContact CD2-NE2 3.18Å; H126-Q130 PolarHBondContact NE2-NE2 2.78Å; H126-Q130 VanDerWaalsContact NE2-NE2 3.13Å; H126-Q130 PolarHBondContact O-NE2 3.13Å
127	I	97.1	Very high	94.9	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-66.8	-44.4	175.8	-64	163.2	0	0	0	110.1	I58 V87 I89 W113 S123 D124 K129 Q130 V131	I58-I127 HydrophobicContact CD1-CD1 3.72Å; V87-I127 HydrophobicContact CB-CD1 4.2Å; V87-I127 HydrophobicContact CB-CG1 4.24Å; V87-I127 HydrophobicContact CG1-CD1 4.3Å; V87-I127 HydrophobicContact CG1-CG1 4.44Å; I89-I127 HydrophobicContact CD1-CG2 3.62Å; I89-I127 HydrophobicContact CG1-CG2 4.14Å; W113-I127 HydrophobicContact CD2-CG2 4.05Å; W113-I127 HydrophobicContact CE3-CG2 3.69Å; W113-I127 HydrophobicContact CH2-CB 3.7Å; W113-I127 HydrophobicContact CH2-CD1 4.08Å; W113-I127 HydrophobicContact CH2-CG2 3.62Å; W113-I127 HydrophobicContact CZ2-CB 4.08Å; W113-I127 HydrophobicContact CZ2-CG2 3.99Å; W113-I127 HydrophobicContact CZ3-CB 4Å; W113-I127 HydrophobicContact CZ3-CD1 4.07Å; W113-I127 HydrophobicContact CZ3-CG2 3.45Å; W113-I127 VanDerWaalsContact CZ3-CG2 3.45Å; S123-I127 WeakPolarHBondContact O-CG1 3.28Å; S123-I127 PolarHBondContact O-N 3.02Å; D124-I127 PolarHBondContact O-N 3.41Å; I127-K129 VanDerWaalsContact C-N 3.3Å; I127-K129 PolarHBondContact O-N 3Å; I127-Q130 WeakPolarHBondContact O-CA 3.39Å; I127-Q130 WeakPolarHBondContact O-CB 3.47Å; I127-Q130 PolarHBondContact O-N 3.49Å; I127-V131 PolarHBondContact O-N 2.94Å; I127-V131 VanDerWaalsContact O-N 3.1Å
128	H	97.6	Very high	95	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-59.4	-40.2	-179.4	-167.5	62.6	0	0	0	112.4	W113 D124 I125 Q130 V131 C132 P138 S159 F172	W113-H128 AromaticContact CD1-ND1 3.72Å; W113-H128 HydrophobicContact CZ2-CB 4.1Å; W113-H128 AromaticContact NE1-CG 3.86Å; W113-H128 AromaticContact NE1-ND1 3.02Å; W113-H128 PolarHBondContact NE1-ND1 2.81Å; D124-H128 WeakPolarHBondContact O-CB 3.39Å; D124-H128 PolarHBondContact O-N 3.38Å; I125-H128 PolarHBondContact O-N 3.03Å; H128-Q130 VanDerWaalsContact C-N 3.28Å; H128-Q130 PolarHBondContact O-N 3Å; H128-V131 CarbonylContact O-C 3.52Å; H128-V131 PolarHBondContact O-N 3.43Å; H128-V131 VanDerWaalsContact O-N 3.07Å; H128-C132 PolarHBondContact O-N 3.03Å; H128-C132 PolarHBondContact O-SG 3.24Å; H128-C132 VanDerWaalsContact O-SG 3.34Å; H128-P138 PolarHBondContact CE1-O 3.08Å; H128-P138 VanDerWaalsContact CE1-O 3.27Å; H128-S159 WeakPolarHBondContact NE2-CB 3.48Å; H128-S159 PolarHBondContact NE2-OG 3.2Å; H128-F172 HydrophobicContact CB-CE1 4.06Å; H128-F172 HydrophobicContact CB-CZ 3.82Å; H128-F172 AromaticContact CD2-CE1 3.58Å; H128-F172 AromaticContact CG-CE1 3.68Å; H128-F172 AromaticContact CG-CZ 3.99Å; H128-F172 AromaticContact NE2-CE1 3.91Å
129	K	96.1	Very high	95.3	Very high	98 Å²	98	49 Å²	49	43%	0.426	26%	0.26	S	S	.	.	H	α-helix	trans	-57.8	-39	172.7	-76	179.1	178.9	-176.3	0	112.7	I125 I127 V131 C132 E133 M170	I125-K129 HydrophobicContact CG2-CD 4.33Å; I125-K129 HydrophobicContact CG2-CG 4.49Å; I125-K129 WeakPolarHBondContact O-CG 3.34Å; I125-K129 PolarHBondContact O-N 3.31Å; I127-K129 VanDerWaalsContact C-N 3.3Å; I127-K129 PolarHBondContact O-N 3Å; K129-V131 VanDerWaalsContact C-N 3.33Å; K129-C132 WeakPolarHBondContact O-CB 3.36Å; K129-C132 PolarHBondContact O-N 2.97Å; K129-E133 PolarHBondContact O-N 2.96Å; K129-M170 HydrophobicContact CG-CE 3.98Å; K129-M170 HydrophobicContact CG-SD 3.67Å
130	Q	96.9	Very high	95.5	Very high	14 Å²	14	43.8 Å²	43.8	7%	0.065	23%	0.226	C	C	.	.	H	α-helix	trans	-67.7	-35	176.1	-63.2	172.3	60.2	0	0	112	V87 H88 H126 I127 H128 E133	V87-Q130 PolarHBondContact O-NE2 2.71Å; H88-Q130 VanDerWaalsContact CA-OE1 3.27Å; H126-Q130 PolarHBondContact CD2-NE2 3.18Å; H126-Q130 PolarHBondContact NE2-NE2 2.78Å; H126-Q130 VanDerWaalsContact NE2-NE2 3.13Å; H126-Q130 PolarHBondContact O-NE2 3.13Å; I127-Q130 WeakPolarHBondContact O-CA 3.39Å; I127-Q130 WeakPolarHBondContact O-CB 3.47Å; I127-Q130 PolarHBondContact O-N 3.49Å; H128-Q130 VanDerWaalsContact C-N 3.28Å; H128-Q130 PolarHBondContact O-N 3Å; Q130-E133 WeakPolarHBondContact O-CB 3.44Å; Q130-E133 PolarHBondContact O-N 3.07Å
131	V	97.3	Very high	95.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-71.1	-34.7	175.3	-175.4	0	0	0	0	111.1	I89 F110 W113 I127 H128 K129 E133 I134 I135 P138	I89-V131 HydrophobicContact CD1-CG2 3.54Å; F110-V131 HydrophobicContact CE1-CG1 3.72Å; F110-V131 HydrophobicContact CZ-CG1 3.79Å; W113-V131 HydrophobicContact CB-CG2 4.11Å; W113-V131 HydrophobicContact CD2-CG2 4.4Å; W113-V131 HydrophobicContact CG-CG2 3.86Å; I127-V131 PolarHBondContact O-N 2.94Å; I127-V131 VanDerWaalsContact O-N 3.1Å; H128-V131 CarbonylContact O-C 3.52Å; H128-V131 PolarHBondContact O-N 3.43Å; H128-V131 VanDerWaalsContact O-N 3.07Å; K129-V131 VanDerWaalsContact C-N 3.33Å; V131-E133 PolarHBondContact O-N 2.85Å; V131-I134 WeakPolarHBondContact O-CA 3.45Å; V131-I134 WeakPolarHBondContact O-CB 3.21Å; V131-I134 PolarHBondContact O-N 3.09Å; V131-I135 HydrophobicContact CG1-CG1 4.45Å; V131-I135 PolarHBondContact O-N 2.92Å; V131-I135 VanDerWaalsContact O-N 3.09Å; V131-P138 HydrophobicContact CB-CB 4.45Å; V131-P138 HydrophobicContact CB-CG 4.25Å; V131-P138 HydrophobicContact CG1-CB 3.6Å; V131-P138 HydrophobicContact CG1-CG 3.85Å
132	C	96.8	Very high	95.9	Very high	34 Å²	34	40.4 Å²	40.4	23%	0.23	21%	0.206	C	C	.	.	H	α-helix	trans	-60.7	-21	172.3	-71	0	0	0	0	113.4	H128 K129 I134 I135	H128-C132 PolarHBondContact O-N 3.03Å; H128-C132 PolarHBondContact O-SG 3.24Å; H128-C132 VanDerWaalsContact O-SG 3.34Å; K129-C132 WeakPolarHBondContact O-CB 3.36Å; K129-C132 PolarHBondContact O-N 2.97Å; C132-I134 VanDerWaalsContact C-N 3.27Å; C132-I135 CarbonylContact C-O 3.57Å; C132-I135 WeakPolarHBondContact CA-O 3.11Å; C132-I135 VanDerWaalsContact O-O 3.12Å
133	E	95.8	Very high	96.1	Very high	129 Å²	129	35.8 Å²	35.8	60%	0.603	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79	-11.7	173.5	-62.8	170.6	-147.6	0	0	112.7	K91 K129 Q130 V131	K91-E133 IonicContact NZ-OE2 3.58Å; K91-E133 PolarHBondContact NZ-OE2 3.02Å; K129-E133 PolarHBondContact O-N 2.96Å; Q130-E133 WeakPolarHBondContact O-CB 3.44Å; Q130-E133 PolarHBondContact O-N 3.07Å; V131-E133 PolarHBondContact O-N 2.85Å
134	I	94.8	Very high	96.2	Very high	33 Å²	33	35.8 Å²	35.8	17%	0.169	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-47.8	175.9	-53.7	174.9	0	0	0	110	Y94 F110 V131 C132	Y94-I134 HydrophobicContact CD1-CD1 3.99Å; Y94-I134 HydrophobicContact CD1-CG2 4.04Å; Y94-I134 HydrophobicContact CE1-CD1 4.41Å; Y94-I134 HydrophobicContact CE1-CG2 3.45Å; Y94-I134 VanDerWaalsContact CE1-CG2 3.45Å; Y94-I134 HydrophobicContact CG-CD1 4.22Å; F110-I134 HydrophobicContact CD1-CG2 3.95Å; F110-I134 HydrophobicContact CE1-CB 4.23Å; F110-I134 HydrophobicContact CE1-CD1 4.4Å; F110-I134 HydrophobicContact CE1-CG2 3.97Å; V131-I134 WeakPolarHBondContact O-CA 3.45Å; V131-I134 WeakPolarHBondContact O-CB 3.21Å; V131-I134 PolarHBondContact O-N 3.09Å; C132-I134 VanDerWaalsContact C-N 3.27Å
135	I	94.4	Very high	96	Very high	43 Å²	43	37.9 Å²	37.9	22%	0.221	20%	0.195	C	C	.	.	S	Bend	trans	-134.7	147.6	178.1	56.4	172.8	0	0	0	110.9	F110 V131 C132 S137 P138	F110-I135 HydrophobicContact CD1-CD1 3.63Å; F110-I135 HydrophobicContact CD1-CG1 3.92Å; F110-I135 HydrophobicContact CD1-CG2 3.83Å; F110-I135 HydrophobicContact CE1-CD1 3.91Å; F110-I135 HydrophobicContact CE1-CG1 4Å; F110-I135 HydrophobicContact CG-CD1 4.34Å; F110-I135 WeakPolarHBondContact O-CD1 3.17Å; V131-I135 HydrophobicContact CG1-CG1 4.45Å; V131-I135 PolarHBondContact O-N 2.92Å; V131-I135 VanDerWaalsContact O-N 3.09Å; C132-I135 CarbonylContact C-O 3.57Å; C132-I135 WeakPolarHBondContact CA-O 3.11Å; C132-I135 VanDerWaalsContact O-O 3.12Å; I135-S137 PolarHBondContact O-N 2.79Å; I135-P138 HydrophobicContact CD1-CB 3.72Å; I135-P138 HydrophobicContact CG1-CB 3.82Å; I135-P138 HydrophobicContact CG1-CG 4.2Å; I135-P138 WeakPolarHBondContact O-CD 3Å
136	E	89.4	Confident	95.7	Very high	191 Å²	191	43.2 Å²	43.2	89%	0.893	22%	0.221	S	C	*	.	S	Bend	trans	-67	-41	-169.4	-63.3	-177.5	173.5	0	0	114.2
137	S	92.3	Very high	95.4	Very high	80 Å²	80	43 Å²	43	56%	0.559	22%	0.223	S	C	*	.	S	Bend	trans	-132.7	71	-175.1	-177.2	0	0	0	0	111.4	I135	I135-S137 PolarHBondContact O-N 2.79Å
138	P	96.9	Very high	94.7	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.265	C	S	.	.			trans	-68.3	144.3	-179.5	18.1	-18.6	0	0	0	112	H128 V131 I135	H128-P138 PolarHBondContact CE1-O 3.08Å; H128-P138 VanDerWaalsContact CE1-O 3.27Å; V131-P138 HydrophobicContact CB-CB 4.45Å; V131-P138 HydrophobicContact CB-CG 4.25Å; V131-P138 HydrophobicContact CG1-CB 3.6Å; V131-P138 HydrophobicContact CG1-CG 3.85Å; I135-P138 HydrophobicContact CD1-CB 3.72Å; I135-P138 HydrophobicContact CG1-CB 3.82Å; I135-P138 HydrophobicContact CG1-CG 4.2Å; I135-P138 WeakPolarHBondContact O-CD 3Å
139	L	97.8	Very high	94	Very high	4 Å²	4	59.6 Å²	59.6	2%	0.021	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	147.2	161.8	-69.1	-179.5	0	0	0	110.7	V28 V30 I70 V72 L111 G112 W113 V156 L175	V28-L139 HydrophobicContact CG2-CD2 4.3Å; V30-L139 HydrophobicContact CG1-CD1 4.4Å; V30-L139 HydrophobicContact CG2-CD1 4.15Å; V30-L139 HydrophobicContact CG2-CD2 4.26Å; I70-L139 HydrophobicContact CB-CD1 4.19Å; I70-L139 HydrophobicContact CD1-CD1 3.98Å; I70-L139 HydrophobicContact CD1-CD2 4.14Å; I70-L139 HydrophobicContact CD1-CG 4.09Å; I70-L139 HydrophobicContact CG2-CD1 3.57Å; V72-L139 HydrophobicContact CG2-CD1 3.98Å; L111-L139 PolarHBondContact O-N 3.47Å; G112-L139 CarbonylContact C-O 3.59Å; G112-L139 WeakPolarHBondContact CA-O 3.4Å; W113-L139 PolarHBondContact N-O 2.76Å; L139-V156 HydrophobicContact CD2-CG1 4.32Å; L139-L175 HydrophobicContact CD2-CD1 3.59Å
140	F	98.3	Very high	93.3	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	118.6	169.9	172.8	-141.1	0	0	0	110.2	W113 T115 P120 D124 K142 V156 Y157 F172	W113-F140 AromaticContact CD2-CD2 3.86Å; W113-F140 HydrophobicContact CD2-CD2 3.86Å; W113-F140 HydrophobicContact CD2-CE2 4.2Å; W113-F140 AromaticContact CE2-CD2 3.28Å; W113-F140 AromaticContact CE2-CE2 3.7Å; W113-F140 AromaticContact CE2-CG 3.95Å; W113-F140 HydrophobicContact CE3-CD2 4.33Å; W113-F140 HydrophobicContact CE3-CE2 4.23Å; W113-F140 HydrophobicContact CG-CD2 4.46Å; W113-F140 AromaticContact CH2-CD2 3.86Å; W113-F140 HydrophobicContact CH2-CD2 3.86Å; W113-F140 AromaticContact CH2-CE2 3.33Å; W113-F140 HydrophobicContact CH2-CE2 3.33Å; W113-F140 AromaticContact CH2-CZ 3.86Å; W113-F140 HydrophobicContact CH2-CZ 3.86Å; W113-F140 HydrophobicContact CZ2-CD1 4.44Å; W113-F140 AromaticContact CZ2-CD2 3.29Å; W113-F140 HydrophobicContact CZ2-CD2 3.29Å; W113-F140 HydrophobicContact CZ2-CE1 4.41Å; W113-F140 AromaticContact CZ2-CE2 3.26Å; W113-F140 HydrophobicContact CZ2-CE2 3.26Å; W113-F140 AromaticContact CZ2-CG 3.91Å; W113-F140 HydrophobicContact CZ2-CG 3.91Å; W113-F140 AromaticContact CZ2-CZ 3.84Å; W113-F140 HydrophobicContact CZ2-CZ 3.84Å; W113-F140 HydrophobicContact CZ3-CD2 4.34Å; W113-F140 AromaticContact CZ3-CE2 3.84Å; W113-F140 HydrophobicContact CZ3-CE2 3.84Å; W113-F140 AromaticContact NE1-CD2 3.51Å; W113-F140 AromaticContact NE1-CG 3.81Å; W113-F140 WeakPolarHBondContact O-CA 3.43Å; T115-F140 HydrophobicContact CG2-CE2 3.65Å; T115-F140 HydrophobicContact CG2-CZ 3.87Å; P120-F140 HydrophobicContact CB-CE1 4.21Å; P120-F140 HydrophobicContact CG-CE1 4.21Å; D124-F140 HydrophobicContact CB-CE1 3.89Å; D124-F140 HydrophobicContact CB-CZ 3.76Å; F140-K142 HydrophobicContact CE1-CB 4.48Å; F140-K142 HydrophobicContact CE1-CD 4.33Å; F140-K142 HydrophobicContact CE2-CB 4.36Å; F140-K142 HydrophobicContact CZ-CB 4.03Å; F140-K142 HydrophobicContact CZ-CD 3.81Å; F140-K142 HydrophobicContact CZ-CG 4.22Å; F140-V156 CarbonylContact O-C 3.55Å; F140-V156 WeakPolarHBondContact O-CA 3.47Å; F140-Y157 AromaticContact CD1-CD2 3.66Å; F140-Y157 HydrophobicContact CD1-CD2 3.66Å; F140-Y157 HydrophobicContact CD1-CE2 4.47Å; F140-Y157 HydrophobicContact CD1-CG 4.21Å; F140-Y157 HydrophobicContact CE1-CD2 4.12Å; F140-Y157 HydrophobicContact CG-CD2 4.32Å; F140-Y157 PolarHBondContact N-O 3.33Å; F140-Y157 PolarHBondContact O-N 3.4Å; F140-F172 HydrophobicContact CB-CE1 4.11Å; F140-F172 AromaticContact CD1-CD1 3.94Å; F140-F172 HydrophobicContact CD1-CD1 3.94Å; F140-F172 HydrophobicContact CD1-CD2 4.37Å; F140-F172 AromaticContact CD1-CE1 3.59Å; F140-F172 HydrophobicContact CD1-CE1 3.59Å; F140-F172 HydrophobicContact CD1-CE2 4.05Å; F140-F172 HydrophobicContact CD1-CG 4.31Å; F140-F172 AromaticContact CD1-CZ 3.65Å; F140-F172 HydrophobicContact CD1-CZ 3.65Å; F140-F172 HydrophobicContact CE1-CD2 4.46Å; F140-F172 HydrophobicContact CE1-CE1 4.37Å; F140-F172 HydrophobicContact CE1-CE2 4.03Å; F140-F172 AromaticContact CE1-CZ 3.98Å; F140-F172 HydrophobicContact CE1-CZ 3.98Å; F140-F172 HydrophobicContact CG-CE1 4.16Å; F140-F172 HydrophobicContact CG-CZ 4.39Å
141	L	98.6	Very high	92.8	Very high	2 Å²	2	66.4 Å²	66.4	1%	0.01	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	127.9	175.5	-172.9	158.2	0	0	0	110.3	L32 I40 L61 W113 Y114 T115 L143 V154 S155 V156	L32-L141 HydrophobicContact CD1-CD1 3.82Å; L32-L141 HydrophobicContact CD2-CD1 4.01Å; I40-L141 HydrophobicContact CD1-CD2 3.6Å; L61-L141 HydrophobicContact CD1-CB 3.72Å; L61-L141 HydrophobicContact CD1-CD1 4.45Å; W113-L141 PolarHBondContact O-N 3.1Å; Y114-L141 CarbonylContact C-O 3.51Å; Y114-L141 WeakPolarHBondContact CA-O 3.13Å; T115-L141 PolarHBondContact N-O 3.21Å; L141-L143 HydrophobicContact CD2-CB 4.41Å; L141-V154 HydrophobicContact CD1-CG1 4.1Å; L141-V154 HydrophobicContact CD2-CG1 3.99Å; L141-V154 HydrophobicContact CG-CG1 3.93Å; L141-S155 WeakPolarHBondContact CA-O 3.18Å; L141-V156 HydrophobicContact CD1-CG2 4.25Å; L141-V156 HydrophobicContact CG-CG2 4.23Å
142	K	97.9	Very high	92.5	Very high	9 Å²	9	70.5 Å²	70.5	4%	0.039	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	122.1	175.6	-157.8	164	-171.4	176.3	0	110.7	T115 G118 P119 D121 D124 F140 S155 Y157	T115-K142 HydrophobicContact CG2-CD 4.2Å; T115-K142 HydrophobicContact CG2-CG 4.01Å; T115-K142 WeakPolarHBondContact O-CA 3.2Å; G118-K142 WeakPolarHBondContact O-CD 3.17Å; G118-K142 WeakPolarHBondContact O-CE 3.42Å; G118-K142 PolarHBondContact O-NZ 3.25Å; P119-K142 PolarHBondContact O-NZ 2.87Å; D121-K142 IonicContact OD2-NZ 3.88Å; D124-K142 IonicContact OD1-NZ 2.55Å; D124-K142 IonicContact OD2-NZ 3.56Å; D124-K142 PolarHBondContact OD2-NZ 2.92Å; F140-K142 HydrophobicContact CE1-CB 4.48Å; F140-K142 HydrophobicContact CE1-CD 4.33Å; F140-K142 HydrophobicContact CE2-CB 4.36Å; F140-K142 HydrophobicContact CZ-CB 4.03Å; F140-K142 HydrophobicContact CZ-CD 3.81Å; F140-K142 HydrophobicContact CZ-CG 4.22Å; K142-S155 PolarHBondContact N-O 3.35Å; K142-S155 PolarHBondContact O-N 3.19Å; K142-Y157 HydrophobicContact CB-CE2 4.18Å
143	L	97.8	Very high	92.4	Very high	11 Å²	11	70.8 Å²	70.8	6%	0.058	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	130.1	177.2	-174.1	153.4	0	0	0	109.9	I37 I40 T115 T116 G117 L141 P145 P153 V154	I37-L143 HydrophobicContact CG2-CD1 3.97Å; I40-L143 HydrophobicContact CB-CD1 4.15Å; I40-L143 HydrophobicContact CG2-CB 4.03Å; I40-L143 HydrophobicContact CG2-CD1 3.91Å; I40-L143 HydrophobicContact CG2-CG 4.39Å; T115-L143 PolarHBondContact O-N 3.35Å; T116-L143 CarbonylContact C-O 3.53Å; T116-L143 WeakPolarHBondContact CA-O 3.48Å; T116-L143 HydrophobicContact CG2-CB 4.49Å; T116-L143 HydrophobicContact CG2-CD2 4.4Å; G117-L143 PolarHBondContact N-O 3.41Å; L141-L143 HydrophobicContact CD2-CB 4.41Å; L143-P145 HydrophobicContact CD2-CB 4.02Å; L143-P145 HydrophobicContact CD2-CG 4.41Å; L143-P145 VanDerWaalsContact O-CD 3.23Å; L143-P145 WeakPolarHBondContact O-CD 3.26Å; L143-P153 CarbonylContact C-O 3.53Å; L143-P153 WeakPolarHBondContact CA-O 3.19Å; L143-V154 HydrophobicContact CD1-CG2 4.05Å; L143-V154 HydrophobicContact CG-CG2 4.16Å
144	N	95.7	Very high	92.4	Very high	48 Å²	48	65 Å²	65	26%	0.257	34%	0.341	S	S	.	.			trans	-103.6	97.2	174.8	-172.1	-8.6	0	0	0	111.5	G117 M146 T147 P153	G117-N144 WeakPolarHBondContact O-CA 3.42Å; G117-N144 WeakPolarHBondContact O-CB 3.41Å; N144-M146 PolarHBondContact O-N 3.16Å; N144-M146 PolarHBondContact OD1-N 3.2Å; N144-T147 PolarHBondContact O-N 3.27Å; N144-T147 PolarHBondContact OD1-N 2.98Å; N144-P153 HydrophobicContact CB-CB 4.11Å; N144-P153 PolarHBondContact N-O 3.4Å; N144-P153 VanDerWaalsContact O-CB 3.3Å; N144-P153 WeakPolarHBondContact O-CB 3.43Å; N144-P153 WeakPolarHBondContact O-CG 3.14Å
145	P	92.9	Very high	92.4	Very high	43 Å²	43	65 Å²	65	28%	0.279	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-9.4	-177.1	30.6	-34.5	0	0	0	113	W44 L143	W44-P145 HydrophobicContact CD2-CB 3.82Å; W44-P145 HydrophobicContact CD2-CG 3.64Å; W44-P145 HydrophobicContact CE3-CB 3.68Å; W44-P145 HydrophobicContact CE3-CG 4.04Å; W44-P145 HydrophobicContact CG-CG 4.14Å; W44-P145 HydrophobicContact CH2-CB 3.86Å; W44-P145 HydrophobicContact CH2-CG 3.95Å; W44-P145 HydrophobicContact CZ2-CB 4.02Å; W44-P145 HydrophobicContact CZ2-CG 3.57Å; W44-P145 HydrophobicContact CZ3-CB 3.71Å; W44-P145 HydrophobicContact CZ3-CG 4.19Å; L143-P145 HydrophobicContact CD2-CB 4.02Å; L143-P145 HydrophobicContact CD2-CG 4.41Å; L143-P145 VanDerWaalsContact O-CD 3.23Å; L143-P145 WeakPolarHBondContact O-CD 3.26Å
146	M	90.2	Very high	92.5	Very high	117 Å²	117	63 Å²	63	58%	0.576	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.1	20.7	-177.8	-60.8	-63.4	-65	0	0	111.8	W44 N144	W44-M146 HydrophobicContact CH2-CG 4.27Å; W44-M146 HydrophobicContact CH2-SD 3.75Å; W44-M146 HydrophobicContact CZ2-CG 4.25Å; W44-M146 HydrophobicContact CZ2-SD 4.24Å; N144-M146 PolarHBondContact O-N 3.16Å; N144-M146 PolarHBondContact OD1-N 3.2Å
147	T	88.6	Confident	92.9	Very high	45 Å²	45	54.6 Å²	54.6	28%	0.276	29%	0.294	S	S	.	.			trans	-58.8	148.2	179.7	-168.1	0	0	0	0	112.1	N144 H149 P153	N144-T147 PolarHBondContact O-N 3.27Å; N144-T147 PolarHBondContact OD1-N 2.98Å; T147-H149 PolarHBondContact OG1-N 3.49Å; T147-H149 VanDerWaalsContact OG1-N 3.11Å; T147-P153 HydrophobicContact CG2-CB 3.51Å; T147-P153 HydrophobicContact CG2-CG 3.59Å
148	K	83.8	Confident	93	Very high	204 Å²	204	51.3 Å²	51.3	89%	0.887	27%	0.269	S	S	*	.			trans	-107.3	-2.3	167.8	-63.8	-178.3	-179	177.9	0	112.4
149	H	81.8	Confident	92.9	Very high	146 Å²	146	52.6 Å²	52.6	68%	0.676	28%	0.278	S	S	*	.	S	Bend	trans	-79.8	156.5	179.6	-61.7	-77.6	0	0	0	110.8	T147	T147-H149 PolarHBondContact OG1-N 3.49Å; T147-H149 VanDerWaalsContact OG1-N 3.11Å
150	T	82.3	Confident	92.6	Very high	140 Å²	140	54.2 Å²	54.2	86%	0.859	29%	0.289	S	S	*	.	S	Bend	trans	-82	-16.4	179.3	49.5	0	0	0	0	113.5
151	D	86.1	Confident	92.2	Very high	116 Å²	116	60.1 Å²	60.1	62%	0.62	32%	0.319	S	S	*	.	S	Bend	trans	-84.1	158.5	-179.1	-57.6	-37.4	0	0	0	111	P153	D151-P153 WeakPolarHBondContact O-CD 3.48Å
152	L	89.7	Confident	91.7	Very high	85 Å²	85	64.2 Å²	64.2	45%	0.445	34%	0.341	S	S	.	.			trans	-58.9	119	177.3	-178.9	64.9	0	0	0	109	I37 V154 Y177 L179	I37-L152 HydrophobicContact CD1-CD2 4.09Å; L152-V154 HydrophobicContact CG-CB 4.44Å; L152-V154 HydrophobicContact CG-CG2 4.19Å; L152-V154 PolarHBondContact O-N 3.42Å; L152-Y177 HydrophobicContact CD2-CE2 4.4Å; L152-Y177 VanDerWaalsContact CD2-OH 3.27Å; L152-Y177 WeakPolarHBondContact CD2-OH 3.23Å; L152-L179 HydrophobicContact CD2-CD1 4.35Å; L152-L179 HydrophobicContact CD2-CD2 4.3Å
153	P	94.6	Very high	91.1	Very high	41 Å²	41	69.6 Å²	69.6	27%	0.266	37%	0.368	S	S	.	.			trans	-83.6	56.3	-170.4	34.6	-38.1	0	0	0	112.4	L143 N144 T147 D151	L143-P153 CarbonylContact C-O 3.53Å; L143-P153 WeakPolarHBondContact CA-O 3.19Å; N144-P153 HydrophobicContact CB-CB 4.11Å; N144-P153 PolarHBondContact N-O 3.4Å; N144-P153 VanDerWaalsContact O-CB 3.3Å; N144-P153 WeakPolarHBondContact O-CB 3.43Å; N144-P153 WeakPolarHBondContact O-CG 3.14Å; T147-P153 HydrophobicContact CG2-CB 3.51Å; T147-P153 HydrophobicContact CG2-CG 3.59Å; D151-P153 WeakPolarHBondContact O-CD 3.48Å
154	V	96.1	Very high	90.4	Very high	7 Å²	7	72.5 Å²	72.5	4%	0.042	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	125.7	178	177.4	0	0	0	0	107.8	L32 I37 L141 L143 L152 Y177	L32-V154 HydrophobicContact CD2-CG1 3.9Å; I37-V154 HydrophobicContact CD1-CG2 4.43Å; I37-V154 HydrophobicContact CG1-CG2 4.46Å; I37-V154 HydrophobicContact CG2-CG2 4.5Å; L141-V154 HydrophobicContact CD1-CG1 4.1Å; L141-V154 HydrophobicContact CD2-CG1 3.99Å; L141-V154 HydrophobicContact CG-CG1 3.93Å; L143-V154 HydrophobicContact CD1-CG2 4.05Å; L143-V154 HydrophobicContact CG-CG2 4.16Å; L152-V154 HydrophobicContact CG-CB 4.44Å; L152-V154 HydrophobicContact CG-CG2 4.19Å; L152-V154 PolarHBondContact O-N 3.42Å; V154-Y177 HydrophobicContact CG1-CE1 4.41Å; V154-Y177 WeakPolarHBondContact O-CE1 3.15Å; V154-Y177 PolarHBondContact O-OH 3Å
155	S	95.8	Very high	89.7	Confident	32 Å²	32	76.2 Å²	76.2	22%	0.224	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	145.5	170.4	-66.6	0	0	0	0	109.3	L141 K142 Y157 E174	L141-S155 WeakPolarHBondContact CA-O 3.18Å; K142-S155 PolarHBondContact N-O 3.35Å; K142-S155 PolarHBondContact O-N 3.19Å; S155-Y157 VanDerWaalsContact CB-CE2 3.5Å; S155-Y157 VanDerWaalsContact CB-CZ 3.41Å; S155-Y157 WeakPolarHBondContact CB-OH 3.22Å; S155-Y157 PolarHBondContact OG-OH 3.02Å; S155-E174 PolarHBondContact OG-OE1 3.04Å; S155-E174 VanDerWaalsContact OG-OE1 3.13Å
156	V	96.8	Very high	89.3	Confident	3 Å²	3	77.4 Å²	77.4	2%	0.018	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	141.6	178.4	-174.3	0	0	0	0	108.2	V30 L139 F140 L141 L175 Y177	V30-V156 HydrophobicContact CG1-CG1 4.41Å; V30-V156 HydrophobicContact CG2-CG1 4.27Å; L139-V156 HydrophobicContact CD2-CG1 4.32Å; F140-V156 CarbonylContact O-C 3.55Å; F140-V156 WeakPolarHBondContact O-CA 3.47Å; L141-V156 HydrophobicContact CD1-CG2 4.25Å; L141-V156 HydrophobicContact CG-CG2 4.23Å; V156-L175 HydrophobicContact CB-CB 4.41Å; V156-L175 HydrophobicContact CG1-CB 4.43Å; V156-L175 HydrophobicContact CG1-CD1 4.27Å; V156-L175 PolarHBondContact O-N 2.9Å; V156-Y177 HydrophobicContact CG2-CD1 3.95Å; V156-Y177 HydrophobicContact CG2-CG 4.31Å
157	Y	96.5	Very high	89.2	Confident	14 Å²	14	78.8 Å²	78.8	6%	0.055	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	149.7	-175.5	-51	-88.8	0	0	0	111	M20 P120 F140 K142 S155 F172 A173 E174	M20-Y157 HydrophobicContact CE-CD1 3.77Å; M20-Y157 HydrophobicContact CE-CE1 3.49Å; M20-Y157 VanDerWaalsContact CE-CE1 3.49Å; M20-Y157 HydrophobicContact SD-CE1 4.25Å; P120-Y157 WeakPolarHBondContact CD-OH 3.1Å; P120-Y157 HydrophobicContact CG-CD1 4.36Å; P120-Y157 HydrophobicContact CG-CD2 4.22Å; P120-Y157 HydrophobicContact CG-CE1 3.82Å; P120-Y157 HydrophobicContact CG-CE2 3.66Å; P120-Y157 VanDerWaalsContact CG-CZ 3.42Å; F140-Y157 AromaticContact CD1-CD2 3.66Å; F140-Y157 HydrophobicContact CD1-CD2 3.66Å; F140-Y157 HydrophobicContact CD1-CE2 4.47Å; F140-Y157 HydrophobicContact CD1-CG 4.21Å; F140-Y157 HydrophobicContact CE1-CD2 4.12Å; F140-Y157 HydrophobicContact CG-CD2 4.32Å; F140-Y157 PolarHBondContact N-O 3.33Å; F140-Y157 PolarHBondContact O-N 3.4Å; K142-Y157 HydrophobicContact CB-CE2 4.18Å; S155-Y157 VanDerWaalsContact CB-CE2 3.5Å; S155-Y157 VanDerWaalsContact CB-CZ 3.41Å; S155-Y157 WeakPolarHBondContact CB-OH 3.22Å; S155-Y157 PolarHBondContact OG-OH 3.02Å; Y157-F172 HydrophobicContact CD1-CB 4.1Å; Y157-F172 HydrophobicContact CG-CB 4.26Å; Y157-A173 CarbonylContact C-O 3.57Å; Y157-A173 WeakPolarHBondContact CA-O 3.3Å; Y157-E174 HydrophobicContact CD1-CB 3.87Å; Y157-E174 HydrophobicContact CD1-CG 4.24Å; Y157-E174 HydrophobicContact CE1-CB 3.81Å; Y157-E174 HydrophobicContact CE1-CG 3.92Å
158	E	95.3	Very high	89.2	Confident	10 Å²	10	80.4 Å²	80.4	5%	0.047	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	161.9	159.3	63.9	-175.8	-179.8	0	0	109.9	G26 S27 F172 A173 L175	G26-E158 WeakPolarHBondContact CA-OE1 3.38Å; S27-E158 WeakPolarHBondContact CB-OE2 3.37Å; S27-E158 PolarHBondContact N-OE1 3.34Å; S27-E158 PolarHBondContact N-OE2 2.86Å; S27-E158 PolarHBondContact OG-OE2 3.33Å; E158-F172 CarbonylContact O-C 3.53Å; E158-F172 WeakPolarHBondContact O-CA 3.42Å; E158-A173 HydrophobicContact CG-CB 4.05Å; E158-A173 PolarHBondContact N-O 2.9Å; E158-A173 PolarHBondContact O-N 3.2Å; E158-L175 HydrophobicContact CB-CD1 4.01Å; E158-L175 HydrophobicContact CB-CD2 4.49Å; E158-L175 HydrophobicContact CB-CG 4.37Å; E158-L175 HydrophobicContact CG-CD1 4.36Å; E158-L175 HydrophobicContact CG-CD2 3.94Å; E158-L175 HydrophobicContact CG-CG 4.23Å
159	S	94.2	Very high	89.5	Confident	27 Å²	27	72.8 Å²	72.8	19%	0.189	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	142	171.6	46.3	0	0	0	0	112.6	H128 L171	H128-S159 WeakPolarHBondContact NE2-CB 3.48Å; H128-S159 PolarHBondContact NE2-OG 3.2Å; S159-L171 CarbonylContact C-O 3.56Å; S159-L171 VanDerWaalsContact CA-O 3.3Å; S159-L171 WeakPolarHBondContact CA-O 3.37Å
160	V	92.2	Very high	90	Very high	39 Å²	39	67 Å²	67	24%	0.236	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	137.4	172.1	-177.1	0	0	0	0	107.8	V24 L171 A173	V24-V160 HydrophobicContact CG1-CG2 4.26Å; V160-L171 PolarHBondContact N-O 3.23Å; V160-L171 PolarHBondContact O-N 3.17Å; V160-A173 HydrophobicContact CG2-CB 3.96Å
161	I	89.4	Confident	90.5	Very high	123 Å²	123	60.8 Å²	60.8	63%	0.631	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.2	119.3	173.1	-58.5	175.3	0	0	0	107.4	A168 T169	I161-A168 HydrophobicContact CG2-CB 4.25Å; I161-T169 WeakPolarHBondContact CA-O 3.36Å
162	D	87.3	Confident	91	Very high	88 Å²	88	55.2 Å²	55.2	47%	0.471	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	156	177.5	-159.6	3.5	0	0	0	110.7	T169 L171	D162-T169 PolarHBondContact N-O 3.04Å; D162-T169 PolarHBondContact O-N 3.32Å; D162-L171 HydrophobicContact CB-CD1 4.28Å
163	I	85.9	Confident	91.2	Very high	122 Å²	122	51.2 Å²	51.2	63%	0.626	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	101.6	179.3	-58.1	176	0	0	0	108.3	E167	I163-E167 WeakPolarHBondContact CA-O 3.46Å
164	I	83.3	Confident	91.1	Very high	72 Å²	72	54.6 Å²	54.6	37%	0.369	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	122.8	176.5	-54.3	171.9	0	0	0	107.5	G166 E167 T169 L171	I164-G166 PolarHBondContact O-N 2.85Å; I164-G166 VanDerWaalsContact O-N 3.11Å; I164-E167 PolarHBondContact N-O 3.25Å; I164-E167 PolarHBondContact O-N 3.47Å; I164-T169 HydrophobicContact CD1-CG2 4.34Å; I164-L171 HydrophobicContact CD1-CD1 3.75Å; I164-L171 HydrophobicContact CD1-CD2 4.01Å; I164-L171 HydrophobicContact CD1-CG 4.18Å
165	S	81.8	Confident	91	Very high	127 Å²	127	54.6 Å²	54.6	89%	0.888	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	30.1	178.7	-57	0	0	0	0	114.4
166	G	84.3	Confident	90.8	Very high	67 Å²	67	59.1 Å²	59.1	69%	0.691	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	86	-0.9	179.7	0	0	0	0	0	115.2	I164	I164-G166 PolarHBondContact O-N 2.85Å; I164-G166 VanDerWaalsContact O-N 3.11Å
167	E	87.3	Confident	90.6	Very high	146 Å²	146	61.6 Å²	61.6	68%	0.682	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.2	132.6	176.3	-66	-170.5	169.1	0	0	111.4	I163 I164 T169	I163-E167 WeakPolarHBondContact CA-O 3.46Å; I164-E167 PolarHBondContact N-O 3.25Å; I164-E167 PolarHBondContact O-N 3.47Å; E167-T169 PolarHBondContact O-N 3.27Å; E167-T169 VanDerWaalsContact O-N 3.13Å; E167-T169 PolarHBondContact O-OG1 3.4Å
168	A	88.2	Confident	90.4	Very high	79 Å²	79	65.1 Å²	65.1	65%	0.653	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.9	108.5	174.2	0	0	0	0	0	109.9	I161	I161-A168 HydrophobicContact CG2-CB 4.25Å
169	T	90	Very high	90.2	Very high	45 Å²	45	68.8 Å²	68.8	28%	0.276	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	137.6	-175.8	-57.9	0	0	0	0	109.9	I161 D162 I164 E167 L171	I161-T169 WeakPolarHBondContact CA-O 3.36Å; D162-T169 PolarHBondContact N-O 3.04Å; D162-T169 PolarHBondContact O-N 3.32Å; I164-T169 HydrophobicContact CD1-CG2 4.34Å; E167-T169 PolarHBondContact O-N 3.27Å; E167-T169 VanDerWaalsContact O-N 3.13Å; E167-T169 PolarHBondContact O-OG1 3.4Å; T169-L171 HydrophobicContact CG2-CD2 4.23Å
170	M	92.3	Very high	89.8	Confident	24 Å²	24	68 Å²	68	12%	0.118	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	128.7	174.5	179.7	-179.2	-79.6	0	0	109.1	I125 K129	I125-M170 WeakPolarHBondContact CD1-O 3.5Å; I125-M170 HydrophobicContact CG2-CB 4.45Å; I125-M170 HydrophobicContact CG2-SD 4.5Å; K129-M170 HydrophobicContact CG-CE 3.98Å; K129-M170 HydrophobicContact CG-SD 3.67Å
171	L	94.2	Very high	88.7	Confident	9 Å²	9	70.1 Å²	70.1	5%	0.047	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	158.9	-179.9	-62.7	178.2	0	0	0	110.4	S18 V19 A21 S159 V160 D162 I164 T169	S18-L171 WeakPolarHBondContact O-CD2 3.33Å; V19-L171 CarbonylContact O-C 3.6Å; V19-L171 WeakPolarHBondContact O-CA 3.49Å; A21-L171 HydrophobicContact CB-CB 3.96Å; A21-L171 HydrophobicContact CB-CD1 4.19Å; S159-L171 CarbonylContact C-O 3.56Å; S159-L171 VanDerWaalsContact CA-O 3.3Å; S159-L171 WeakPolarHBondContact CA-O 3.37Å; V160-L171 PolarHBondContact N-O 3.23Å; V160-L171 PolarHBondContact O-N 3.17Å; D162-L171 HydrophobicContact CB-CD1 4.28Å; I164-L171 HydrophobicContact CD1-CD1 3.75Å; I164-L171 HydrophobicContact CD1-CD2 4.01Å; I164-L171 HydrophobicContact CD1-CG 4.18Å; T169-L171 HydrophobicContact CG2-CD2 4.23Å
172	F	95.4	Very high	88.4	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	132.7	174.5	-68	-60.2	0	0	0	112	V19 M20 A21 P120 D124 I125 H128 F140 Y157 E158	V19-F172 PolarHBondContact O-N 3.48Å; M20-F172 CarbonylContact C-O 3.4Å; M20-F172 WeakPolarHBondContact CA-O 3.27Å; M20-F172 HydrophobicContact CE-CB 4.27Å; M20-F172 WeakPolarHBondContact CE-O 3.36Å; M20-F172 HydrophobicContact SD-CB 3.9Å; A21-F172 PolarHBondContact N-O 3.32Å; P120-F172 HydrophobicContact CB-CD2 3.72Å; P120-F172 HydrophobicContact CB-CE2 4.18Å; P120-F172 HydrophobicContact CG-CD2 4.46Å; D124-F172 HydrophobicContact CB-CE2 3.96Å; D124-F172 HydrophobicContact CB-CZ 4.25Å; I125-F172 HydrophobicContact CG1-CD2 4.28Å; I125-F172 HydrophobicContact CG1-CE2 3.67Å; I125-F172 HydrophobicContact CG1-CZ 4.25Å; H128-F172 HydrophobicContact CB-CE1 4.06Å; H128-F172 HydrophobicContact CB-CZ 3.82Å; H128-F172 AromaticContact CD2-CE1 3.58Å; H128-F172 AromaticContact CG-CE1 3.68Å; H128-F172 AromaticContact CG-CZ 3.99Å; H128-F172 AromaticContact NE2-CE1 3.91Å; F140-F172 HydrophobicContact CB-CE1 4.11Å; F140-F172 AromaticContact CD1-CD1 3.94Å; F140-F172 HydrophobicContact CD1-CD1 3.94Å; F140-F172 HydrophobicContact CD1-CD2 4.37Å; F140-F172 AromaticContact CD1-CE1 3.59Å; F140-F172 HydrophobicContact CD1-CE1 3.59Å; F140-F172 HydrophobicContact CD1-CE2 4.05Å; F140-F172 HydrophobicContact CD1-CG 4.31Å; F140-F172 AromaticContact CD1-CZ 3.65Å; F140-F172 HydrophobicContact CD1-CZ 3.65Å; F140-F172 HydrophobicContact CE1-CD2 4.46Å; F140-F172 HydrophobicContact CE1-CE1 4.37Å; F140-F172 HydrophobicContact CE1-CE2 4.03Å; F140-F172 AromaticContact CE1-CZ 3.98Å; F140-F172 HydrophobicContact CE1-CZ 3.98Å; F140-F172 HydrophobicContact CG-CE1 4.16Å; F140-F172 HydrophobicContact CG-CZ 4.39Å; Y157-F172 HydrophobicContact CD1-CB 4.1Å; Y157-F172 HydrophobicContact CG-CB 4.26Å; E158-F172 CarbonylContact O-C 3.53Å; E158-F172 WeakPolarHBondContact O-CA 3.42Å
173	A	94.1	Very high	88.1	Confident	1 Å²	1	71.2 Å²	71.2	1%	0.008	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	126.9	168.6	0	0	0	0	0	109.2	A21 V24 Y157 E158 V160	A21-A173 HydrophobicContact CB-CB 4.32Å; V24-A173 HydrophobicContact CB-CB 4.44Å; Y157-A173 CarbonylContact C-O 3.57Å; Y157-A173 WeakPolarHBondContact CA-O 3.3Å; E158-A173 HydrophobicContact CG-CB 4.05Å; E158-A173 PolarHBondContact N-O 2.9Å; E158-A173 PolarHBondContact O-N 3.2Å; V160-A173 HydrophobicContact CG2-CB 3.96Å
174	E	93.4	Very high	88.2	Confident	112 Å²	112	68.6 Å²	68.6	52%	0.523	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	134.7	-179	-170.8	169.4	-163	0	0	111.4	S155 Y157	S155-E174 PolarHBondContact OG-OE1 3.04Å; S155-E174 VanDerWaalsContact OG-OE1 3.13Å; Y157-E174 HydrophobicContact CD1-CB 3.87Å; Y157-E174 HydrophobicContact CD1-CG 4.24Å; Y157-E174 HydrophobicContact CE1-CB 3.81Å; Y157-E174 HydrophobicContact CE1-CG 3.92Å
175	L	92.9	Very high	88.3	Confident	6 Å²	6	66.7 Å²	66.7	3%	0.031	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	135.3	179.8	-63.8	178.6	0	0	0	110.5	V28 V30 L139 V156 E158	V28-L175 HydrophobicContact CG2-CD1 3.6Å; V28-L175 HydrophobicContact CG2-CD2 4.27Å; V30-L175 HydrophobicContact CG2-CB 4.48Å; V30-L175 HydrophobicContact CG2-CD1 3.92Å; L139-L175 HydrophobicContact CD2-CD1 3.59Å; V156-L175 HydrophobicContact CB-CB 4.41Å; V156-L175 HydrophobicContact CG1-CB 4.43Å; V156-L175 HydrophobicContact CG1-CD1 4.27Å; V156-L175 PolarHBondContact O-N 2.9Å; E158-L175 HydrophobicContact CB-CD1 4.01Å; E158-L175 HydrophobicContact CB-CD2 4.49Å; E158-L175 HydrophobicContact CB-CG 4.37Å; E158-L175 HydrophobicContact CG-CD1 4.36Å; E158-L175 HydrophobicContact CG-CD2 3.94Å; E158-L175 HydrophobicContact CG-CG 4.23Å
176	T	91.1	Very high	88.4	Confident	128 Å²	128	64.6 Å²	64.6	79%	0.785	37%	0.368	S	S	*	.			trans	-73.9	135.9	166	57.1	0	0	0	0	109.9
177	Y	93.8	Very high	88.4	Confident	55 Å²	55	65.6 Å²	65.6	22%	0.216	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	156.2	175.7	70.3	-86.2	0	0	0	111.5	V30 L32 L152 V154 V156 L179	V30-Y177 CarbonylContact O-C 3.31Å; V30-Y177 WeakPolarHBondContact O-CA 3.19Å; V30-Y177 WeakPolarHBondContact O-CB 3.41Å; L32-Y177 HydrophobicContact CB-CD2 3.92Å; L32-Y177 HydrophobicContact CD2-CD2 4.03Å; L32-Y177 HydrophobicContact CD2-CE2 3.95Å; L152-Y177 HydrophobicContact CD2-CE2 4.4Å; L152-Y177 VanDerWaalsContact CD2-OH 3.27Å; L152-Y177 WeakPolarHBondContact CD2-OH 3.23Å; V154-Y177 HydrophobicContact CG1-CE1 4.41Å; V154-Y177 WeakPolarHBondContact O-CE1 3.15Å; V154-Y177 PolarHBondContact O-OH 3Å; V156-Y177 HydrophobicContact CG2-CD1 3.95Å; V156-Y177 HydrophobicContact CG2-CG 4.31Å; Y177-L179 HydrophobicContact CE2-CD2 3.98Å; Y177-L179 HydrophobicContact CE2-CG 4.45Å
178	T	92.9	Very high	88.3	Confident	87 Å²	87	60.4 Å²	60.4	53%	0.534	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	147.8	168.6	54.7	0	0	0	0	109.7	V30 A31 L32 A180	V30-T178 PolarHBondContact O-N 2.91Å; A31-T178 CarbonylContact C-O 3.52Å; A31-T178 WeakPolarHBondContact CA-O 3.12Å; L32-T178 PolarHBondContact N-O 3.28Å; T178-A180 PolarHBondContact O-N 3.16Å
179	L	91.3	Very high	88.2	Confident	87 Å²	87	59.3 Å²	59.3	46%	0.455	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	115.6	169.2	-67.2	175.7	0	0	0	109	L32 I37 L152 Y177	L32-L179 CarbonylContact O-C 3.59Å; L32-L179 WeakPolarHBondContact O-CA 3.34Å; I37-L179 HydrophobicContact CD1-CD2 4.01Å; L152-L179 HydrophobicContact CD2-CD1 4.35Å; L152-L179 HydrophobicContact CD2-CD2 4.3Å; Y177-L179 HydrophobicContact CE2-CD2 3.98Å; Y177-L179 HydrophobicContact CE2-CG 4.45Å
180	A	84	Confident	87.8	Confident	12 Å²	12	59.1 Å²	59.1	10%	0.099	33%	0.325	C	S	.	.			trans	-70.9	140.1	168.7	0	0	0	0	0	108.3	A31 L32 H33 P34 T178	A31-A180 HydrophobicContact CB-CB 4.11Å; L32-A180 PolarHBondContact O-N 3.32Å; H33-A180 WeakPolarHBondContact NE2-CB 3.44Å; P34-A180 WeakPolarHBondContact CD-O 3.48Å; T178-A180 PolarHBondContact O-N 3.16Å
181	T	70.4	Confident	87.4	Confident	83 Å²	83	62.8 Å²	62.8	51%	0.509	34%	0.341	S	S	.	.			trans	-137.3	101.4	174	60.6	0	0	0	0	109.3
182	E	82.6	Confident	86.9	Confident	124 Å²	124	66.5 Å²	66.5	58%	0.579	36%	0.364	S	S	*	.			trans	-64.4	146.1	159.6	-171.4	-179.4	170.6	0	0	108.8	A184 E185 R186	E182-A184 VanDerWaalsContact C-N 3.28Å; E182-A184 PolarHBondContact O-N 3.19Å; E182-E185 HydrophobicContact CB-CB 4.18Å; E182-E185 PolarHBondContact O-N 2.76Å; E182-E185 VanDerWaalsContact O-N 3.11Å; E182-R186 WeakPolarHBondContact O-CB 3.37Å; E182-R186 PolarHBondContact O-N 3.04Å
183	E	81.2	Confident	86.2	Confident	109 Å²	109	69.5 Å²	69.5	51%	0.509	39%	0.389	S	S	.	.	H	α-helix	trans	-58.8	-39.8	-175.2	-177.8	60.6	-169.8	0	0	112.6	R186 I187	E183-R186 VanDerWaalsContact CD-NH2 3.33Å; E183-R186 PolarHBondContact O-N 3.46Å; E183-R186 IonicContact OE1-CZ 3.96Å; E183-R186 IonicContact OE1-NE 2.77Å; E183-R186 IonicContact OE1-NH2 2.76Å; E183-R186 PolarHBondContact OE1-NH2 3.06Å; E183-R186 IonicContact OE2-CZ 3.18Å; E183-R186 IonicContact OE2-NE 2.77Å; E183-R186 PolarHBondContact OE2-NE 3.25Å; E183-R186 IonicContact OE2-NH2 3.75Å; E183-R186 PolarHBondContact OE2-NH2 3.35Å; E183-I187 HydrophobicContact CG-CD1 4.23Å; E183-I187 WeakPolarHBondContact O-CD1 3.18Å; E183-I187 VanDerWaalsContact O-CG1 3.27Å; E183-I187 WeakPolarHBondContact O-CG1 3.25Å; E183-I187 PolarHBondContact O-N 3.48Å; E183-I187 VanDerWaalsContact O-N 3.08Å
184	A	87.1	Confident	85.4	Confident	67 Å²	67	72.2 Å²	72.2	55%	0.554	40%	0.399	S	S	*	.	H	α-helix	trans	-64.9	-44.1	176.1	0	0	0	0	0	112	E182 I187 G188	E182-A184 VanDerWaalsContact C-N 3.28Å; E182-A184 PolarHBondContact O-N 3.19Å; A184-I187 PolarHBondContact O-N 3.02Å; A184-G188 PolarHBondContact O-N 2.94Å
185	E	86.7	Confident	84.3	Confident	32 Å²	32	73.1 Å²	73.1	15%	0.15	41%	0.405	C	S	.	.	H	α-helix	trans	-64.7	-42.5	177.1	-174	177.5	-158.6	0	0	111.2	H33 P34 L35 E182 I187 G188 V189	H33-E185 IonicContact CE1-OE2 2.63Å; H33-E185 IonicContact CG-OE2 2.71Å; H33-E185 IonicContact ND1-OE2 3.92Å; H33-E185 PolarHBondContact ND1-OE2 3.4Å; P34-E185 VanDerWaalsContact CD-OE1 3.24Å; P34-E185 WeakPolarHBondContact CD-OE1 3.25Å; L35-E185 WeakPolarHBondContact CB-OE1 3.44Å; L35-E185 PolarHBondContact N-OE1 3.16Å; E182-E185 HydrophobicContact CB-CB 4.18Å; E182-E185 PolarHBondContact O-N 2.76Å; E182-E185 VanDerWaalsContact O-N 3.11Å; E185-I187 VanDerWaalsContact C-N 3.33Å; E185-I187 PolarHBondContact O-N 3.45Å; E185-G188 PolarHBondContact O-N 3.47Å; E185-G188 VanDerWaalsContact O-N 3.12Å; E185-V189 HydrophobicContact CG-CG2 4.24Å; E185-V189 WeakPolarHBondContact O-CG2 3.36Å; E185-V189 PolarHBondContact O-N 3.31Å
186	R	84.1	Confident	82.7	Confident	83 Å²	83	78.9 Å²	78.9	31%	0.313	44%	0.441	S	S	.	.	H	α-helix	trans	-56.5	-47.2	176.3	-167.8	-173.6	66.8	71.9	-0.2	111.2	E182 E183 D190	E182-R186 WeakPolarHBondContact O-CB 3.37Å; E182-R186 PolarHBondContact O-N 3.04Å; E183-R186 VanDerWaalsContact CD-NH2 3.33Å; E183-R186 PolarHBondContact O-N 3.46Å; E183-R186 IonicContact OE1-CZ 3.96Å; E183-R186 IonicContact OE1-NE 2.77Å; E183-R186 IonicContact OE1-NH2 2.76Å; E183-R186 PolarHBondContact OE1-NH2 3.06Å; E183-R186 IonicContact OE2-CZ 3.18Å; E183-R186 IonicContact OE2-NE 2.77Å; E183-R186 PolarHBondContact OE2-NE 3.25Å; E183-R186 IonicContact OE2-NH2 3.75Å; E183-R186 PolarHBondContact OE2-NH2 3.35Å; R186-D190 WeakPolarHBondContact O-CB 3.44Å; R186-D190 PolarHBondContact O-N 2.61Å
187	I	84.2	Confident	81.2	Confident	89 Å²	89	76.7 Å²	76.7	46%	0.456	44%	0.435	S	S	.	.	H	α-helix	trans	-63.4	-42.9	177	-67	165.1	0	0	0	110.6	E183 A184 E185 H191	E183-I187 HydrophobicContact CG-CD1 4.23Å; E183-I187 WeakPolarHBondContact O-CD1 3.18Å; E183-I187 VanDerWaalsContact O-CG1 3.27Å; E183-I187 WeakPolarHBondContact O-CG1 3.25Å; E183-I187 PolarHBondContact O-N 3.48Å; E183-I187 VanDerWaalsContact O-N 3.08Å; A184-I187 PolarHBondContact O-N 3.02Å; E185-I187 VanDerWaalsContact C-N 3.33Å; E185-I187 PolarHBondContact O-N 3.45Å; I187-H191 WeakPolarHBondContact O-CB 3.44Å; I187-H191 PolarHBondContact O-N 3.48Å
188	G	85.5	Confident	79.3	Confident	36 Å²	36	77.8 Å²	77.8	37%	0.371	45%	0.448	S	S	.	.	H	α-helix	trans	-62	-50.1	178.2	0	0	0	0	0	113	A184 E185 D190 H191 V192	A184-G188 PolarHBondContact O-N 2.94Å; E185-G188 PolarHBondContact O-N 3.47Å; E185-G188 VanDerWaalsContact O-N 3.12Å; G188-D190 PolarHBondContact O-N 2.84Å; G188-H191 PolarHBondContact O-N 3.43Å; G188-V192 WeakPolarHBondContact O-CG2 3.37Å; G188-V192 PolarHBondContact O-N 3.4Å
189	V	85.3	Confident	77.6	Confident	57 Å²	57	77.1 Å²	77.1	35%	0.345	46%	0.458	S	S	.	.	H	α-helix	trans	-61.7	-45.4	178.6	172.5	0	0	0	0	111	P34 E185 H191 V192 A193	P34-V189 HydrophobicContact CB-CG2 3.72Å; P34-V189 HydrophobicContact CG-CG2 4.2Å; E185-V189 HydrophobicContact CG-CG2 4.24Å; E185-V189 WeakPolarHBondContact O-CG2 3.36Å; E185-V189 PolarHBondContact O-N 3.31Å; V189-H191 VanDerWaalsContact C-N 3.32Å; V189-H191 PolarHBondContact O-N 3.35Å; V189-V192 PolarHBondContact O-N 3.07Å; V189-A193 WeakPolarHBondContact O-CB 3.4Å; V189-A193 PolarHBondContact O-N 2.92Å
190	D	82.3	Confident	75.8	Confident	41 Å²	41	80.4 Å²	80.4	22%	0.219	48%	0.482	C	S	.	.	H	α-helix	trans	-62	-38.7	177.8	174.8	62.8	0	0	0	112.2	R186 G188 R194	R186-D190 WeakPolarHBondContact O-CB 3.44Å; R186-D190 PolarHBondContact O-N 2.61Å; G188-D190 PolarHBondContact O-N 2.84Å; D190-R194 PolarHBondContact O-N 2.87Å; D190-R194 VanDerWaalsContact O-N 3.13Å; D190-R194 IonicContact OD1-CZ 2.61Å; D190-R194 IonicContact OD1-NH1 3.59Å; D190-R194 PolarHBondContact OD1-NH1 3.5Å; D190-R194 IonicContact OD2-CZ 3.77Å; D190-R194 IonicContact OD2-NH1 3.62Å; D190-R194 PolarHBondContact OD2-NH1 3.33Å; D190-R194 IonicContact OD2-NH2 3.1Å; D190-R194 PolarHBondContact OD2-NH2 2.95Å
191	H	83.4	Confident	74.6	Confident	100 Å²	100	81.9 Å²	81.9	46%	0.463	50%	0.498	S	S	.	.	H	α-helix	trans	-65.1	-50.4	173.1	-174.3	76.2	0	0	0	112	I187 G188 V189 A193 R194 M195	I187-H191 WeakPolarHBondContact O-CB 3.44Å; I187-H191 PolarHBondContact O-N 3.48Å; G188-H191 PolarHBondContact O-N 3.43Å; V189-H191 VanDerWaalsContact C-N 3.32Å; V189-H191 PolarHBondContact O-N 3.35Å; H191-A193 VanDerWaalsContact C-N 3.3Å; H191-A193 PolarHBondContact O-N 3.42Å; H191-R194 PolarHBondContact O-N 3.41Å; H191-R194 VanDerWaalsContact O-N 3.11Å; H191-M195 VanDerWaalsContact CD2-SD 3.55Å; H191-M195 PolarHBondContact NE2-SD 3.37Å; H191-M195 WeakPolarHBondContact O-CG 3.39Å; H191-M195 PolarHBondContact O-N 2.93Å
192	V	84.4	Confident	74.1	Confident	87 Å²	87	87.7 Å²	87.7	53%	0.527	52%	0.52	S	S	.	.	H	α-helix	trans	-58.3	-42.9	179	171.5	0	0	0	0	111.1	G188 V189 R194 M195 T196	G188-V192 WeakPolarHBondContact O-CG2 3.37Å; G188-V192 PolarHBondContact O-N 3.4Å; V189-V192 PolarHBondContact O-N 3.07Å; V192-R194 VanDerWaalsContact C-N 3.33Å; V192-R194 PolarHBondContact O-N 3.08Å; V192-M195 PolarHBondContact O-N 3.22Å; V192-T196 PolarHBondContact O-OG1 2.92Å
193	A	80.4	Confident	72.9	Confident	63 Å²	63	85.6 Å²	85.6	52%	0.521	51%	0.513	S	S	.	.	H	α-helix	trans	-64.8	-34.3	177.7	0	0	0	0	0	113	V189 H191	V189-A193 WeakPolarHBondContact O-CB 3.4Å; V189-A193 PolarHBondContact O-N 2.92Å; H191-A193 VanDerWaalsContact C-N 3.3Å; H191-A193 PolarHBondContact O-N 3.42Å
194	R	76.9	Confident	72.5	Confident	58 Å²	58	83.9 Å²	83.9	22%	0.219	51%	0.513	C	S	.	.	H	α-helix	trans	-79.1	-34.3	177.7	-84.1	-158.7	-62.2	-80.7	-7.3	114.3	D190 H191 V192 T196 A197 T198	D190-R194 PolarHBondContact O-N 2.87Å; D190-R194 VanDerWaalsContact O-N 3.13Å; D190-R194 IonicContact OD1-CZ 2.61Å; D190-R194 IonicContact OD1-NH1 3.59Å; D190-R194 PolarHBondContact OD1-NH1 3.5Å; D190-R194 IonicContact OD2-CZ 3.77Å; D190-R194 IonicContact OD2-NH1 3.62Å; D190-R194 PolarHBondContact OD2-NH1 3.33Å; D190-R194 IonicContact OD2-NH2 3.1Å; D190-R194 PolarHBondContact OD2-NH2 2.95Å; H191-R194 PolarHBondContact O-N 3.41Å; H191-R194 VanDerWaalsContact O-N 3.11Å; V192-R194 VanDerWaalsContact C-N 3.33Å; V192-R194 PolarHBondContact O-N 3.08Å; R194-T196 PolarHBondContact O-N 2.94Å; R194-T196 VanDerWaalsContact O-N 3.08Å; R194-A197 PolarHBondContact O-N 3.46Å; R194-T198 PolarHBondContact O-N 3.35Å; R194-T198 PolarHBondContact O-OG1 3Å
195	M	70.9	Confident	71.5	Confident	131 Å²	131	86 Å²	86	65%	0.645	52%	0.519	S	S	*	.	H	α-helix	trans	-56.2	-27.4	178.8	-75.2	-175.9	76.3	0	0	112.1	H191 V192	H191-M195 VanDerWaalsContact CD2-SD 3.55Å; H191-M195 PolarHBondContact NE2-SD 3.37Å; H191-M195 WeakPolarHBondContact O-CG 3.39Å; H191-M195 PolarHBondContact O-N 2.93Å; V192-M195 PolarHBondContact O-N 3.22Å
196	T	58.3	Low	70.8	Confident	128 Å²	128	88.9 Å²	88.9	79%	0.785	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-20.7	175.8	-20.4	0	0	0	0	113.5	V192 R194	V192-T196 PolarHBondContact O-OG1 2.92Å; R194-T196 PolarHBondContact O-N 2.94Å; R194-T196 VanDerWaalsContact O-N 3.08Å
197	A	59.1	Low	70.1	Confident	81 Å²	81	86.9 Å²	86.9	67%	0.669	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	-24.6	-169	0	0	0	0	0	114.8	R194	R194-A197 PolarHBondContact O-N 3.46Å
198	T	55.3	Low	69.4	Low	78 Å²	78	86.8 Å²	86.8	48%	0.479	54%	0.538	S	S	.	.	S	Bend	trans	-132	121.4	-177.3	47.7	0	0	0	0	111.4	R194	R194-T198 PolarHBondContact O-N 3.35Å; R194-T198 PolarHBondContact O-OG1 3Å
199	G	55.6	Low	68.6	Low	73 Å²	73	90.6 Å²	90.6	75%	0.753	55%	0.545	S	S	*	.			trans	-58.3	153.9	171.6	0	0	0	0	0	112	G201	G199-G201 PolarHBondContact O-N 3.28Å
200	T	55	Low	68.3	Low	156 Å²	156	92.7 Å²	92.7	96%	0.957	55%	0.554	S	S	*	*			trans	-65.7	64.5	-175.8	52.2	0	0	0	0	113.3
201	G	59	Low	68	Low	43 Å²	43	94 Å²	94	44%	0.443	56%	0.56	S	S	.	*			trans	-91.7	137.7	167.5	0	0	0	0	0	110.2	G199 N203	G199-G201 PolarHBondContact O-N 3.28Å; G201-N203 VanDerWaalsContact C-N 3.34Å; G201-N203 PolarHBondContact O-N 2.95Å
202	E	58.1	Low	67.5	Low	205 Å²	205	90.1 Å²	90.1	96%	0.958	55%	0.546	S	S	*	.			trans	-62	91	173.4	-64.7	-179.4	161.3	0	0	110.1
203	N	59.3	Low	67.5	Low	80 Å²	80	89.2 Å²	89.2	43%	0.428	54%	0.536	S	S	.	.			trans	-89.1	150.3	175.1	-71.7	-23.5	0	0	0	110.1	G201 E208	G201-N203 VanDerWaalsContact C-N 3.34Å; G201-N203 PolarHBondContact O-N 2.95Å; N203-E208 HydrophobicContact CB-CG 3.73Å
204	S	71.1	Confident	67.6	Low	73 Å²	73	92 Å²	92	51%	0.51	54%	0.538	S	S	.	.			trans	-61.4	138.2	171.3	177.3	0	0	0	0	109.9	V206 A207 E208	S204-V206 PolarHBondContact O-N 3.49Å; S204-V206 VanDerWaalsContact O-N 3.12Å; S204-A207 WeakPolarHBondContact O-CA 3.43Å; S204-A207 WeakPolarHBondContact O-CB 3.37Å; S204-A207 PolarHBondContact O-N 3.31Å; S204-E208 PolarHBondContact O-N 3.07Å
205	T	66.9	Low	67.6	Low	113 Å²	113	92.2 Å²	92.2	69%	0.693	55%	0.549	S	S	*	.	H	α-helix	trans	-54.5	-31.9	176.2	53.9	0	0	0	0	113.2	H209	T205-H209 WeakPolarHBondContact O-CB 3.18Å; T205-H209 PolarHBondContact O-N 3.41Å; T205-H209 VanDerWaalsContact O-N 3.08Å
206	V	71.9	Confident	68.2	Low	91 Å²	91	88.6 Å²	88.6	55%	0.552	54%	0.539	S	S	*	.	H	α-helix	trans	-69.4	-42.1	174.1	178.5	0	0	0	0	110.9	S204 H209 L210	S204-V206 PolarHBondContact O-N 3.49Å; S204-V206 VanDerWaalsContact O-N 3.12Å; V206-H209 PolarHBondContact O-N 2.9Å; V206-L210 HydrophobicContact CG1-CD1 3.79Å; V206-L210 HydrophobicContact CG1-CG 4.31Å; V206-L210 WeakPolarHBondContact O-CB 3.36Å; V206-L210 VanDerWaalsContact O-CG 3.22Å; V206-L210 WeakPolarHBondContact O-CG 3.38Å; V206-L210 PolarHBondContact O-N 3.41Å
207	A	69.7	Low	69.7	Low	42 Å²	42	87.8 Å²	87.8	35%	0.347	53%	0.529	S	S	.	.	H	α-helix	trans	-65	-44.2	177.5	0	0	0	0	0	110.9	S204 H209 L210 I211	S204-A207 WeakPolarHBondContact O-CA 3.43Å; S204-A207 WeakPolarHBondContact O-CB 3.37Å; S204-A207 PolarHBondContact O-N 3.31Å; A207-H209 PolarHBondContact O-N 3.19Å; A207-L210 PolarHBondContact O-N 3.11Å; A207-I211 VanDerWaalsContact O-CD1 3.31Å; A207-I211 WeakPolarHBondContact O-CD1 3.09Å; A207-I211 WeakPolarHBondContact O-CG1 3.46Å; A207-I211 PolarHBondContact O-N 3.39Å
208	E	68.3	Low	71.1	Confident	87 Å²	87	90.7 Å²	90.7	41%	0.407	53%	0.527	S	S	.	.	H	α-helix	trans	-60.6	-44.1	177	-68.5	-175.4	166	0	0	112.6	N203 S204	N203-E208 HydrophobicContact CB-CG 3.73Å; S204-E208 PolarHBondContact O-N 3.07Å
209	H	70.4	Confident	72.5	Confident	115 Å²	115	92.9 Å²	92.9	53%	0.532	53%	0.533	S	S	.	.	H	α-helix	trans	-60.3	-56.4	175.5	-168.5	72.2	0	0	0	110.1	T205 V206 A207 I211 A212 Q213	T205-H209 WeakPolarHBondContact O-CB 3.18Å; T205-H209 PolarHBondContact O-N 3.41Å; T205-H209 VanDerWaalsContact O-N 3.08Å; V206-H209 PolarHBondContact O-N 2.9Å; A207-H209 PolarHBondContact O-N 3.19Å; H209-I211 VanDerWaalsContact C-N 3.25Å; H209-I211 PolarHBondContact O-N 3.35Å; H209-I211 VanDerWaalsContact O-N 3.15Å; H209-A212 PolarHBondContact O-N 3.16Å; H209-A212 VanDerWaalsContact O-N 3.17Å; H209-Q213 PolarHBondContact CD2-NE2 3.49Å; H209-Q213 VanDerWaalsContact CD2-NE2 3.35Å; H209-Q213 PolarHBondContact CE1-NE2 3.2Å; H209-Q213 VanDerWaalsContact CE1-NE2 3.29Å; H209-Q213 PolarHBondContact NE2-NE2 2.9Å; H209-Q213 PolarHBondContact O-OE1 3.06Å
210	L	78.8	Confident	74.2	Confident	102 Å²	102	94.8 Å²	94.8	53%	0.534	53%	0.525	S	S	.	.	H	α-helix	trans	-62.2	-25.3	-174.3	-69.4	177.8	0	0	0	114.5	V206 A207 A212 Q213 H214	V206-L210 HydrophobicContact CG1-CD1 3.79Å; V206-L210 HydrophobicContact CG1-CG 4.31Å; V206-L210 WeakPolarHBondContact O-CB 3.36Å; V206-L210 VanDerWaalsContact O-CG 3.22Å; V206-L210 WeakPolarHBondContact O-CG 3.38Å; V206-L210 PolarHBondContact O-N 3.41Å; A207-L210 PolarHBondContact O-N 3.11Å; L210-A212 VanDerWaalsContact C-N 3.32Å; L210-A212 PolarHBondContact O-N 3Å; L210-Q213 VanDerWaalsContact CA-OE1 3.25Å; L210-Q213 PolarHBondContact O-N 3.4Å; L210-H214 WeakPolarHBondContact O-CB 3.39Å; L210-H214 PolarHBondContact O-N 3.21Å
211	I	76.2	Confident	75.9	Confident	67 Å²	67	93.3 Å²	93.3	34%	0.344	51%	0.507	S	S	.	.	H	α-helix	trans	-61.8	-40.4	177.4	-75.8	160.4	0	0	0	111.5	A207 H209 H214 S215	A207-I211 VanDerWaalsContact O-CD1 3.31Å; A207-I211 WeakPolarHBondContact O-CD1 3.09Å; A207-I211 WeakPolarHBondContact O-CG1 3.46Å; A207-I211 PolarHBondContact O-N 3.39Å; H209-I211 VanDerWaalsContact C-N 3.25Å; H209-I211 PolarHBondContact O-N 3.35Å; H209-I211 VanDerWaalsContact O-N 3.15Å; I211-H214 PolarHBondContact O-N 3.02Å; I211-S215 WeakPolarHBondContact O-CB 3.24Å; I211-S215 PolarHBondContact O-N 3.17Å; I211-S215 PolarHBondContact O-OG 3.27Å
212	A	72.9	Confident	77.5	Confident	19 Å²	19	94.3 Å²	94.3	16%	0.157	51%	0.507	C	S	.	.	H	α-helix	trans	-65.6	-49	-179.9	0	0	0	0	0	110.7	H209 L210 H214 S215 A216	H209-A212 PolarHBondContact O-N 3.16Å; H209-A212 VanDerWaalsContact O-N 3.17Å; L210-A212 VanDerWaalsContact C-N 3.32Å; L210-A212 PolarHBondContact O-N 3Å; A212-H214 PolarHBondContact O-N 3.49Å; A212-S215 PolarHBondContact O-N 3.47Å; A212-A216 PolarHBondContact O-N 3.11Å
213	Q	82.8	Confident	79.1	Confident	68 Å²	68	92 Å²	92	32%	0.318	49%	0.49	S	S	.	.	H	α-helix	trans	-65.6	-38.7	176.4	-63.9	94.7	3.4	0	0	111.9	H209 L210 S215 A216 I217	H209-Q213 PolarHBondContact CD2-NE2 3.49Å; H209-Q213 VanDerWaalsContact CD2-NE2 3.35Å; H209-Q213 PolarHBondContact CE1-NE2 3.2Å; H209-Q213 VanDerWaalsContact CE1-NE2 3.29Å; H209-Q213 PolarHBondContact NE2-NE2 2.9Å; H209-Q213 PolarHBondContact O-OE1 3.06Å; L210-Q213 VanDerWaalsContact CA-OE1 3.25Å; L210-Q213 PolarHBondContact O-N 3.4Å; Q213-S215 VanDerWaalsContact C-N 3.32Å; Q213-S215 PolarHBondContact O-N 3.32Å; Q213-A216 PolarHBondContact O-N 2.87Å; Q213-I217 WeakPolarHBondContact O-CB 3.42Å; Q213-I217 WeakPolarHBondContact O-CD1 3.22Å; Q213-I217 VanDerWaalsContact O-CG1 3.22Å; Q213-I217 WeakPolarHBondContact O-CG1 3.49Å; Q213-I217 PolarHBondContact O-N 3.46Å
214	H	82.8	Confident	80.7	Confident	121 Å²	121	91.9 Å²	91.9	56%	0.56	49%	0.492	S	S	*	.	H	α-helix	trans	-60.6	-43.1	176.9	-178.4	78.6	0	0	0	111.6	L210 I211 A212 I217 K218	L210-H214 WeakPolarHBondContact O-CB 3.39Å; L210-H214 PolarHBondContact O-N 3.21Å; I211-H214 PolarHBondContact O-N 3.02Å; A212-H214 PolarHBondContact O-N 3.49Å; H214-I217 PolarHBondContact O-N 2.81Å; H214-K218 VanDerWaalsContact O-CB 3.27Å; H214-K218 WeakPolarHBondContact O-CB 3.42Å; H214-K218 PolarHBondContact O-N 3.3Å
215	S	77.3	Confident	81.9	Confident	64 Å²	64	94.1 Å²	94.1	45%	0.448	49%	0.492	S	S	.	.	H	α-helix	trans	-64	-41.7	177.2	-58.9	0	0	0	0	111.8	I211 A212 Q213 K218 M219	I211-S215 WeakPolarHBondContact O-CB 3.24Å; I211-S215 PolarHBondContact O-N 3.17Å; I211-S215 PolarHBondContact O-OG 3.27Å; A212-S215 PolarHBondContact O-N 3.47Å; Q213-S215 VanDerWaalsContact C-N 3.32Å; Q213-S215 PolarHBondContact O-N 3.32Å; S215-K218 PolarHBondContact O-N 3.26Å; S215-M219 WeakPolarHBondContact O-CB 3.18Å; S215-M219 PolarHBondContact O-N 2.96Å
216	A	83.3	Confident	83.2	Confident	55 Å²	55	93.4 Å²	93.4	46%	0.455	48%	0.483	S	S	.	.	H	α-helix	trans	-62.9	-45.3	174.4	0	0	0	0	0	112.2	A212 Q213 K218 M219 L220	A212-A216 PolarHBondContact O-N 3.11Å; Q213-A216 PolarHBondContact O-N 2.87Å; A216-K218 PolarHBondContact O-N 2.79Å; A216-M219 PolarHBondContact O-N 3.47Å; A216-L220 PolarHBondContact O-N 2.87Å
217	I	89.7	Confident	84.3	Confident	110 Å²	110	92.4 Å²	92.4	56%	0.564	47%	0.474	S	S	*	.	H	α-helix	trans	-62.5	-42.6	176.1	-67.8	163.8	0	0	0	110.7	Q213 H214 M219 L220 H221	Q213-I217 WeakPolarHBondContact O-CB 3.42Å; Q213-I217 WeakPolarHBondContact O-CD1 3.22Å; Q213-I217 VanDerWaalsContact O-CG1 3.22Å; Q213-I217 WeakPolarHBondContact O-CG1 3.49Å; Q213-I217 PolarHBondContact O-N 3.46Å; H214-I217 PolarHBondContact O-N 2.81Å; I217-M219 VanDerWaalsContact C-N 3.33Å; I217-M219 PolarHBondContact O-N 3.02Å; I217-L220 PolarHBondContact O-N 2.87Å; I217-H221 VanDerWaalsContact O-CB 3.31Å; I217-H221 WeakPolarHBondContact O-CB 3.34Å; I217-H221 PolarHBondContact O-N 2.83Å
218	K	88.9	Confident	85.5	Confident	143 Å²	143	94.6 Å²	94.6	62%	0.622	48%	0.48	S	S	*	.	H	α-helix	trans	-62.2	-41.2	177.4	-175.9	179.2	178.2	-178.3	0	111.5	H214 S215 A216 H221 S222	H214-K218 VanDerWaalsContact O-CB 3.27Å; H214-K218 WeakPolarHBondContact O-CB 3.42Å; H214-K218 PolarHBondContact O-N 3.3Å; S215-K218 PolarHBondContact O-N 3.26Å; A216-K218 PolarHBondContact O-N 2.79Å; K218-H221 PolarHBondContact O-N 3.46Å; K218-S222 PolarHBondContact O-N 3.42Å
219	M	84.4	Confident	86.8	Confident	123 Å²	123	94.8 Å²	94.8	61%	0.606	48%	0.48	S	S	*	.	H	α-helix	trans	-64.4	-46.7	175.5	-175.1	161.2	65.6	0	0	111.4	S215 A216 I217 H221 S222 R223	S215-M219 WeakPolarHBondContact O-CB 3.18Å; S215-M219 PolarHBondContact O-N 2.96Å; A216-M219 PolarHBondContact O-N 3.47Å; I217-M219 VanDerWaalsContact C-N 3.33Å; I217-M219 PolarHBondContact O-N 3.02Å; M219-H221 PolarHBondContact O-N 2.93Å; M219-S222 WeakPolarHBondContact O-CB 3.35Å; M219-S222 PolarHBondContact O-N 2.85Å; M219-R223 WeakPolarHBondContact O-CG 3.45Å; M219-R223 PolarHBondContact O-N 2.93Å; M219-R223 VanDerWaalsContact O-N 3.08Å
220	L	90.9	Very high	88	Confident	114 Å²	114	92.1 Å²	92.1	60%	0.597	47%	0.466	S	S	*	.	H	α-helix	trans	-58.7	-47.6	175.2	179.2	60.4	0	0	0	111.6	A216 I217 S222 R223 V224	A216-L220 PolarHBondContact O-N 2.87Å; I217-L220 PolarHBondContact O-N 2.87Å; L220-S222 VanDerWaalsContact C-N 3.3Å; L220-S222 PolarHBondContact O-N 3.27Å; L220-R223 PolarHBondContact O-N 3.4Å; L220-R223 VanDerWaalsContact O-N 3.14Å; L220-V224 HydrophobicContact CD1-CG2 4.24Å; L220-V224 HydrophobicContact CG-CG2 4.44Å; L220-V224 WeakPolarHBondContact O-CG2 3.38Å; L220-V224 PolarHBondContact O-N 3.45Å
221	H	91.9	Very high	88.8	Confident	124 Å²	124	89.8 Å²	89.8	57%	0.574	46%	0.456	S	S	*	.	H	α-helix	trans	-58.1	-42.3	177.3	173.2	-88.7	0	0	0	111.9	I217 K218 M219 R223 V224 K225	I217-H221 VanDerWaalsContact O-CB 3.31Å; I217-H221 WeakPolarHBondContact O-CB 3.34Å; I217-H221 PolarHBondContact O-N 2.83Å; K218-H221 PolarHBondContact O-N 3.46Å; M219-H221 PolarHBondContact O-N 2.93Å; H221-R223 PolarHBondContact O-N 3.43Å; H221-V224 PolarHBondContact O-N 3.28Å; H221-K225 WeakPolarHBondContact O-CB 3.38Å; H221-K225 PolarHBondContact O-N 2.65Å
222	S	92	Very high	89.8	Confident	64 Å²	64	90.9 Å²	90.9	45%	0.448	46%	0.458	S	S	.	.	H	α-helix	trans	-59.3	-46	175.1	-169.7	0	0	0	0	111.8	K218 M219 L220 K225 I226	K218-S222 PolarHBondContact O-N 3.42Å; M219-S222 WeakPolarHBondContact O-CB 3.35Å; M219-S222 PolarHBondContact O-N 2.85Å; L220-S222 VanDerWaalsContact C-N 3.3Å; L220-S222 PolarHBondContact O-N 3.27Å; S222-K225 PolarHBondContact O-N 2.99Å; S222-I226 WeakPolarHBondContact O-CG1 3.33Å; S222-I226 PolarHBondContact O-N 3.49Å
223	R	91.3	Very high	90.9	Very high	158 Å²	158	90.8 Å²	90.8	60%	0.596	46%	0.457	S	S	*	.	H	α-helix	trans	-62.9	-45.9	177.3	-63.9	-70.3	-175	-167.4	1.4	112.1	M219 L220 H221 K225 I226 I227	M219-R223 WeakPolarHBondContact O-CG 3.45Å; M219-R223 PolarHBondContact O-N 2.93Å; M219-R223 VanDerWaalsContact O-N 3.08Å; L220-R223 PolarHBondContact O-N 3.4Å; L220-R223 VanDerWaalsContact O-N 3.14Å; H221-R223 PolarHBondContact O-N 3.43Å; R223-K225 VanDerWaalsContact C-N 3.29Å; R223-K225 PolarHBondContact O-N 3.07Å; R223-I226 PolarHBondContact O-N 3.49Å; R223-I227 WeakPolarHBondContact O-CG1 3.35Å; R223-I227 PolarHBondContact O-N 3.02Å; R223-I227 VanDerWaalsContact O-N 3.07Å
224	V	93.9	Very high	91.5	Very high	77 Å²	77	88.1 Å²	88.1	47%	0.467	45%	0.446	S	S	.	.	H	α-helix	trans	-60.7	-40.9	176.4	172.5	0	0	0	0	111	L220 H221 I226 I227 L228	L220-V224 HydrophobicContact CD1-CG2 4.24Å; L220-V224 HydrophobicContact CG-CG2 4.44Å; L220-V224 WeakPolarHBondContact O-CG2 3.38Å; L220-V224 PolarHBondContact O-N 3.45Å; H221-V224 PolarHBondContact O-N 3.28Å; V224-I226 PolarHBondContact O-N 3.13Å; V224-I227 PolarHBondContact O-N 2.94Å; V224-L228 PolarHBondContact O-N 3.3Å
225	K	95.5	Very high	92.1	Very high	120 Å²	120	90.3 Å²	90.3	52%	0.522	46%	0.456	S	S	.	.	H	α-helix	trans	-62.2	-42.4	176.1	-172	175.5	-178.9	-179.5	0	111.8	H221 S222 R223 I227 L228 E229	H221-K225 WeakPolarHBondContact O-CB 3.38Å; H221-K225 PolarHBondContact O-N 2.65Å; S222-K225 PolarHBondContact O-N 2.99Å; R223-K225 VanDerWaalsContact C-N 3.29Å; R223-K225 PolarHBondContact O-N 3.07Å; K225-I227 PolarHBondContact O-N 2.85Å; K225-L228 PolarHBondContact O-N 2.89Å; K225-E229 HydrophobicContact CG-CG 4.47Å; K225-E229 WeakPolarHBondContact O-CG 3.31Å; K225-E229 PolarHBondContact O-N 3.47Å
226	I	94.4	Very high	93	Very high	97 Å²	97	90.7 Å²	90.7	50%	0.497	46%	0.463	S	S	.	.	H	α-helix	trans	-60.7	-44.9	176.2	-67.5	163.7	0	0	0	110.9	S222 R223 V224 L228 E229 Y230	S222-I226 WeakPolarHBondContact O-CG1 3.33Å; S222-I226 PolarHBondContact O-N 3.49Å; R223-I226 PolarHBondContact O-N 3.49Å; V224-I226 PolarHBondContact O-N 3.13Å; I226-L228 VanDerWaalsContact C-N 3.33Å; I226-L228 PolarHBondContact O-N 3.49Å; I226-E229 PolarHBondContact O-N 2.82Å; I226-Y230 WeakPolarHBondContact O-CB 3.43Å; I226-Y230 PolarHBondContact O-N 3.33Å
227	I	94.6	Very high	93.5	Very high	71 Å²	71	91 Å²	91	36%	0.364	47%	0.472	S	S	.	.	H	α-helix	trans	-61.1	-44	177.2	-64.4	166.8	0	0	0	110.6	R223 V224 K225 Y230 V231 A249 L252	R223-I227 WeakPolarHBondContact O-CG1 3.35Å; R223-I227 PolarHBondContact O-N 3.02Å; R223-I227 VanDerWaalsContact O-N 3.07Å; V224-I227 PolarHBondContact O-N 2.94Å; K225-I227 PolarHBondContact O-N 2.85Å; I227-Y230 PolarHBondContact O-N 3.14Å; I227-V231 WeakPolarHBondContact O-CG2 3.49Å; I227-V231 PolarHBondContact O-N 3.37Å; I227-A249 HydrophobicContact CG2-CB 4.3Å; I227-L252 HydrophobicContact CD1-CD2 4.37Å
228	L	95.6	Very high	93.7	Very high	88 Å²	88	93.4 Å²	93.4	46%	0.461	48%	0.481	S	S	.	.	H	α-helix	trans	-61.4	-47	178	177.3	63	0	0	0	112.2	V224 K225 I226 Y230 V231 K232	V224-L228 PolarHBondContact O-N 3.3Å; K225-L228 PolarHBondContact O-N 2.89Å; I226-L228 VanDerWaalsContact C-N 3.33Å; I226-L228 PolarHBondContact O-N 3.49Å; L228-Y230 VanDerWaalsContact C-N 3.32Å; L228-Y230 PolarHBondContact O-N 3.08Å; L228-V231 PolarHBondContact O-N 3.25Å; L228-K232 WeakPolarHBondContact O-CG 3.47Å; L228-K232 PolarHBondContact O-N 2.99Å; L228-K232 VanDerWaalsContact O-N 3.08Å
229	E	96.3	Very high	94	Very high	90 Å²	90	89 Å²	89	42%	0.421	47%	0.466	S	S	.	.	H	α-helix	trans	-65.4	-36.4	178.2	-65.8	-55.1	132.2	0	0	111.6	K225 I226 K232 A233	K225-E229 HydrophobicContact CG-CG 4.47Å; K225-E229 WeakPolarHBondContact O-CG 3.31Å; K225-E229 PolarHBondContact O-N 3.47Å; I226-E229 PolarHBondContact O-N 2.82Å; E229-K232 PolarHBondContact O-N 3.48Å; E229-K232 IonicContact OE1-NZ 3.59Å; E229-K232 PolarHBondContact OE1-NZ 3.29Å; E229-A233 WeakPolarHBondContact O-CB 3.34Å; E229-A233 PolarHBondContact O-N 2.94Å
230	Y	95.6	Very high	94.4	Very high	60 Å²	60	88.5 Å²	88.5	24%	0.235	47%	0.471	C	S	.	.	H	α-helix	trans	-60.9	-47.5	173	177.1	-97.4	0	0	0	112.1	I226 I227 L228 K232 A233 V234 V239 N242 I245	I226-Y230 WeakPolarHBondContact O-CB 3.43Å; I226-Y230 PolarHBondContact O-N 3.33Å; I227-Y230 PolarHBondContact O-N 3.14Å; L228-Y230 VanDerWaalsContact C-N 3.32Å; L228-Y230 PolarHBondContact O-N 3.08Å; Y230-K232 VanDerWaalsContact C-N 3.33Å; Y230-K232 PolarHBondContact O-N 3.49Å; Y230-A233 PolarHBondContact O-N 3.48Å; Y230-V234 HydrophobicContact CD1-CG2 4.36Å; Y230-V234 HydrophobicContact CE1-CG2 3.91Å; Y230-V234 HydrophobicContact CE2-CG2 4.16Å; Y230-V234 WeakPolarHBondContact O-CG2 3.48Å; Y230-V234 PolarHBondContact O-N 3.13Å; Y230-V239 HydrophobicContact CD2-CG1 4.44Å; Y230-V239 HydrophobicContact CE2-CG1 3.78Å; Y230-N242 WeakPolarHBondContact OH-CB 3.3Å; Y230-I245 HydrophobicContact CD1-CG2 4.09Å; Y230-I245 HydrophobicContact CE1-CB 4.2Å; Y230-I245 HydrophobicContact CE1-CG2 3.52Å
231	V	95.6	Very high	94.5	Very high	52 Å²	52	89 Å²	89	32%	0.315	47%	0.469	S	S	.	.	H	α-helix	trans	-60.8	-42.9	178.5	172.9	0	0	0	0	111.2	I227 L228 V234 E235 L246 A249	I227-V231 WeakPolarHBondContact O-CG2 3.49Å; I227-V231 PolarHBondContact O-N 3.37Å; L228-V231 PolarHBondContact O-N 3.25Å; V231-V234 PolarHBondContact O-N 3.21Å; V231-E235 PolarHBondContact O-N 3.04Å; V231-L246 HydrophobicContact CG2-CD2 4.08Å; V231-A249 HydrophobicContact CG2-CB 4.47Å
232	K	96.1	Very high	94.7	Very high	91 Å²	91	85.7 Å²	85.7	40%	0.396	46%	0.456	S	S	.	.	H	α-helix	trans	-63.3	-41.4	175.4	-70.1	173.9	-174.6	167.3	0	112.5	L228 E229 Y230 V234 E235 A236	L228-K232 WeakPolarHBondContact O-CG 3.47Å; L228-K232 PolarHBondContact O-N 2.99Å; L228-K232 VanDerWaalsContact O-N 3.08Å; E229-K232 PolarHBondContact O-N 3.48Å; E229-K232 IonicContact OE1-NZ 3.59Å; E229-K232 PolarHBondContact OE1-NZ 3.29Å; Y230-K232 VanDerWaalsContact C-N 3.33Å; Y230-K232 PolarHBondContact O-N 3.49Å; K232-V234 VanDerWaalsContact C-N 3.32Å; K232-V234 PolarHBondContact O-N 2.93Å; K232-E235 PolarHBondContact O-N 3.5Å; K232-A236 WeakPolarHBondContact O-CB 3.35Å; K232-A236 PolarHBondContact O-N 3.49Å
233	A	96.1	Very high	94.7	Very high	17 Å²	17	89.6 Å²	89.6	14%	0.14	47%	0.466	C	S	.	.	H	α-helix	trans	-66.1	-36	179.6	0	0	0	0	0	111.9	E229 Y230 G237 E238 V239	E229-A233 WeakPolarHBondContact O-CB 3.34Å; E229-A233 PolarHBondContact O-N 2.94Å; Y230-A233 PolarHBondContact O-N 3.48Å; A233-G237 PolarHBondContact O-N 3.01Å; A233-E238 PolarHBondContact O-N 2.88Å; A233-V239 HydrophobicContact CB-CB 4.4Å; A233-V239 HydrophobicContact CB-CG2 3.77Å; A233-V239 PolarHBondContact O-N 3.31Å
234	V	96	Very high	94.8	Very high	12 Å²	12	88.2 Å²	88.2	7%	0.073	47%	0.467	C	S	.	.	H	α-helix	trans	-68.8	-41.5	172.9	176.3	0	0	0	0	111.2	Y230 V231 K232 A236 G237 V239 F241 L246	Y230-V234 HydrophobicContact CD1-CG2 4.36Å; Y230-V234 HydrophobicContact CE1-CG2 3.91Å; Y230-V234 HydrophobicContact CE2-CG2 4.16Å; Y230-V234 WeakPolarHBondContact O-CG2 3.48Å; Y230-V234 PolarHBondContact O-N 3.13Å; V231-V234 PolarHBondContact O-N 3.21Å; K232-V234 VanDerWaalsContact C-N 3.32Å; K232-V234 PolarHBondContact O-N 2.93Å; V234-A236 VanDerWaalsContact C-N 3.34Å; V234-A236 PolarHBondContact O-N 3.22Å; V234-G237 PolarHBondContact O-N 3.44Å; V234-G237 VanDerWaalsContact O-N 3.16Å; V234-V239 HydrophobicContact CG2-CB 4.05Å; V234-V239 HydrophobicContact CG2-CG1 4.08Å; V234-F241 HydrophobicContact CG1-CB 4.33Å; V234-F241 HydrophobicContact CG1-CD2 3.64Å; V234-F241 HydrophobicContact CG1-CE2 4.27Å; V234-F241 HydrophobicContact CG1-CG 4.22Å; V234-L246 HydrophobicContact CG1-CD1 4.08Å
235	E	94.9	Very high	94.8	Very high	167 Å²	167	87.9 Å²	87.9	78%	0.78	46%	0.462	S	S	*	.	H	α-helix	trans	-61.7	-40.3	174.6	-177	-178	-156.5	0	0	112.2	V231 K232 G237	V231-E235 PolarHBondContact O-N 3.04Å; K232-E235 PolarHBondContact O-N 3.5Å; E235-G237 PolarHBondContact O-N 2.9Å
236	A	95.8	Very high	94.7	Very high	71 Å²	71	83.8 Å²	83.8	59%	0.587	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-11.2	176.6	0	0	0	0	0	113.8	K232 V234 E238	K232-A236 WeakPolarHBondContact O-CB 3.35Å; K232-A236 PolarHBondContact O-N 3.49Å; V234-A236 VanDerWaalsContact C-N 3.34Å; V234-A236 PolarHBondContact O-N 3.22Å; A236-E238 VanDerWaalsContact C-N 3.34Å; A236-E238 HydrophobicContact CB-CG 4.22Å
237	G	93.8	Very high	94.8	Very high	63 Å²	63	87.6 Å²	87.6	65%	0.649	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	14	-177.7	0	0	0	0	0	114.8	A233 V234 E235	A233-G237 PolarHBondContact O-N 3.01Å; V234-G237 PolarHBondContact O-N 3.44Å; V234-G237 VanDerWaalsContact O-N 3.16Å; E235-G237 PolarHBondContact O-N 2.9Å
238	E	94.6	Very high	94.7	Very high	160 Å²	160	90.3 Å²	90.3	75%	0.748	47%	0.465	S	S	*	.	S	Bend	trans	-76.6	-26.7	177	-63.8	-176.6	172.9	0	0	112.2	A233 A236	A233-E238 PolarHBondContact O-N 2.88Å; A236-E238 VanDerWaalsContact C-N 3.34Å; A236-E238 HydrophobicContact CB-CG 4.22Å
239	V	94.1	Very high	94.7	Very high	51 Å²	51	86.9 Å²	86.9	31%	0.309	45%	0.449	S	S	.	.	S	Bend	trans	-123.4	142.9	-177.1	178.1	0	0	0	0	110	Y230 A233 V234	Y230-V239 HydrophobicContact CD2-CG1 4.44Å; Y230-V239 HydrophobicContact CE2-CG1 3.78Å; A233-V239 HydrophobicContact CB-CB 4.4Å; A233-V239 HydrophobicContact CB-CG2 3.77Å; A233-V239 PolarHBondContact O-N 3.31Å; V234-V239 HydrophobicContact CG2-CB 4.05Å; V234-V239 HydrophobicContact CG2-CG1 4.08Å
240	P	93.4	Very high	94.6	Very high	111 Å²	111	86.9 Å²	86.9	72%	0.721	45%	0.452	S	S	*	.			trans	-56.7	139.9	177.2	-25.7	34.6	0	0	0	113.2	N242	P240-N242 PolarHBondContact O-N 2.96Å
241	F	93.9	Very high	94.5	Very high	124 Å²	124	86 Å²	86	54%	0.544	46%	0.457	S	S	.	.			trans	-68.8	114.3	178.7	-165.3	-78.7	0	0	0	111	V234 H243 L246	V234-F241 HydrophobicContact CG1-CB 4.33Å; V234-F241 HydrophobicContact CG1-CD2 3.64Å; V234-F241 HydrophobicContact CG1-CE2 4.27Å; V234-F241 HydrophobicContact CG1-CG 4.22Å; F241-H243 AromaticContact CD1-CD2 3.73Å; F241-H243 AromaticContact CD1-CE1 3.72Å; F241-H243 AromaticContact CD1-CG 3.98Å; F241-H243 AromaticContact CD1-ND1 4Å; F241-H243 AromaticContact CD1-NE2 3.56Å; F241-H243 HydrophobicContact CE1-CB 4.49Å; F241-H243 AromaticContact CE1-CD2 3.88Å; F241-H243 AromaticContact CE1-CE1 3.3Å; F241-H243 WeakPolarHBondContact CE1-CE1 3.27Å; F241-H243 AromaticContact CE1-CG 3.68Å; F241-H243 AromaticContact CE1-ND1 3.34Å; F241-H243 VanDerWaalsContact CE1-ND1 3.34Å; F241-H243 WeakPolarHBondContact CE1-ND1 3.48Å; F241-H243 AromaticContact CE1-NE2 3.65Å; F241-L246 HydrophobicContact CD1-CD1 4.11Å; F241-L246 HydrophobicContact CD2-CD1 3.96Å; F241-L246 HydrophobicContact CE1-CD1 3.57Å; F241-L246 HydrophobicContact CE2-CD1 3.44Å; F241-L246 VanDerWaalsContact CE2-CD1 3.44Å; F241-L246 HydrophobicContact CG-CD1 4.28Å; F241-L246 HydrophobicContact CZ-CD1 3.23Å
242	N	94.4	Very high	94.4	Very high	56 Å²	56	87.6 Å²	87.6	30%	0.299	46%	0.463	S	S	.	.			trans	-109.1	107.4	175.2	-172	-31.3	0	0	0	110.7	Y230 P240 E244 I245 L246	Y230-N242 WeakPolarHBondContact OH-CB 3.3Å; P240-N242 PolarHBondContact O-N 2.96Å; N242-E244 VanDerWaalsContact C-N 3.31Å; N242-E244 PolarHBondContact O-N 3.45Å; N242-E244 PolarHBondContact OD1-N 3.01Å; N242-I245 HydrophobicContact CB-CB 4.36Å; N242-I245 HydrophobicContact CB-CD1 4.26Å; N242-I245 HydrophobicContact CB-CG1 4.39Å; N242-I245 WeakPolarHBondContact ND2-CD1 3.35Å; N242-I245 PolarHBondContact OD1-N 2.67Å; N242-L246 WeakPolarHBondContact O-CB 3.38Å; N242-L246 VanDerWaalsContact O-CG 3.3Å; N242-L246 WeakPolarHBondContact O-CG 3.45Å; N242-L246 PolarHBondContact O-N 3.2Å
243	H	93.2	Very high	94.2	Very high	145 Å²	145	87.1 Å²	87.1	67%	0.671	47%	0.471	S	S	*	.	H	α-helix	trans	-62.8	-33.6	-179	-70.9	-86.8	0	0	0	113.4	F241 R247	F241-H243 AromaticContact CD1-CD2 3.73Å; F241-H243 AromaticContact CD1-CE1 3.72Å; F241-H243 AromaticContact CD1-CG 3.98Å; F241-H243 AromaticContact CD1-ND1 4Å; F241-H243 AromaticContact CD1-NE2 3.56Å; F241-H243 HydrophobicContact CE1-CB 4.49Å; F241-H243 AromaticContact CE1-CD2 3.88Å; F241-H243 AromaticContact CE1-CE1 3.3Å; F241-H243 WeakPolarHBondContact CE1-CE1 3.27Å; F241-H243 AromaticContact CE1-CG 3.68Å; F241-H243 AromaticContact CE1-ND1 3.34Å; F241-H243 VanDerWaalsContact CE1-ND1 3.34Å; F241-H243 WeakPolarHBondContact CE1-ND1 3.48Å; F241-H243 AromaticContact CE1-NE2 3.65Å; H243-R247 WeakPolarHBondContact O-CB 3.37Å; H243-R247 PolarHBondContact O-N 3.36Å
244	E	93.2	Very high	94	Very high	129 Å²	129	93.1 Å²	93.1	60%	0.603	50%	0.496	S	S	*	.	H	α-helix	trans	-70.5	-51.6	-176.9	-63.5	-170.9	155.9	0	0	110.9	N242 L246 R247 E248	N242-E244 VanDerWaalsContact C-N 3.31Å; N242-E244 PolarHBondContact O-N 3.45Å; N242-E244 PolarHBondContact OD1-N 3.01Å; E244-L246 VanDerWaalsContact C-N 3.34Å; E244-L246 PolarHBondContact O-N 3.4Å; E244-R247 WeakPolarHBondContact O-CB 3.49Å; E244-R247 PolarHBondContact O-N 2.83Å; E244-E248 WeakPolarHBondContact O-CG 3.48Å; E244-E248 PolarHBondContact O-N 3.27Å
245	I	93.4	Very high	93.7	Very high	70 Å²	70	101.4 Å²	101.4	36%	0.359	53%	0.526	S	S	.	.	H	α-helix	trans	-62.1	-42.4	179.6	-61.6	177.1	0	0	0	110.8	Y230 N242 R247 E248 A249	Y230-I245 HydrophobicContact CD1-CG2 4.09Å; Y230-I245 HydrophobicContact CE1-CB 4.2Å; Y230-I245 HydrophobicContact CE1-CG2 3.52Å; N242-I245 HydrophobicContact CB-CB 4.36Å; N242-I245 HydrophobicContact CB-CD1 4.26Å; N242-I245 HydrophobicContact CB-CG1 4.39Å; N242-I245 WeakPolarHBondContact ND2-CD1 3.35Å; N242-I245 PolarHBondContact OD1-N 2.67Å; I245-R247 VanDerWaalsContact C-N 3.34Å; I245-R247 PolarHBondContact O-N 3.27Å; I245-E248 PolarHBondContact O-N 2.83Å; I245-A249 WeakPolarHBondContact O-CB 3.33Å; I245-A249 PolarHBondContact O-N 3.08Å
246	L	94	Very high	93.5	Very high	35 Å²	35	98.8 Å²	98.8	18%	0.183	52%	0.516	C	S	.	.	H	α-helix	trans	-66.8	-36.2	178.1	-70.4	175.2	0	0	0	112.4	V231 V234 F241 N242 E244 E248 A249 N250	V231-L246 HydrophobicContact CG2-CD2 4.08Å; V234-L246 HydrophobicContact CG1-CD1 4.08Å; F241-L246 HydrophobicContact CD1-CD1 4.11Å; F241-L246 HydrophobicContact CD2-CD1 3.96Å; F241-L246 HydrophobicContact CE1-CD1 3.57Å; F241-L246 HydrophobicContact CE2-CD1 3.44Å; F241-L246 VanDerWaalsContact CE2-CD1 3.44Å; F241-L246 HydrophobicContact CG-CD1 4.28Å; F241-L246 HydrophobicContact CZ-CD1 3.23Å; N242-L246 WeakPolarHBondContact O-CB 3.38Å; N242-L246 VanDerWaalsContact O-CG 3.3Å; N242-L246 WeakPolarHBondContact O-CG 3.45Å; N242-L246 PolarHBondContact O-N 3.2Å; E244-L246 VanDerWaalsContact C-N 3.34Å; E244-L246 PolarHBondContact O-N 3.4Å; L246-E248 VanDerWaalsContact C-N 3.33Å; L246-A249 PolarHBondContact O-N 3.4Å; L246-N250 VanDerWaalsContact O-CB 3.28Å; L246-N250 WeakPolarHBondContact O-CB 3.46Å; L246-N250 PolarHBondContact O-N 2.94Å
247	R	95.4	Very high	93.1	Very high	176 Å²	176	99.9 Å²	99.9	66%	0.664	52%	0.518	S	S	*	.	H	α-helix	trans	-63.9	-41.5	174.2	-176	-179.4	67.7	164.2	-0.5	111	H243 E244 I245 N250 A251	H243-R247 WeakPolarHBondContact O-CB 3.37Å; H243-R247 PolarHBondContact O-N 3.36Å; E244-R247 WeakPolarHBondContact O-CB 3.49Å; E244-R247 PolarHBondContact O-N 2.83Å; I245-R247 VanDerWaalsContact C-N 3.34Å; I245-R247 PolarHBondContact O-N 3.27Å; R247-N250 PolarHBondContact O-N 3.12Å; R247-A251 WeakPolarHBondContact O-CB 3.27Å; R247-A251 PolarHBondContact O-N 2.94Å
248	E	94.3	Very high	92.7	Very high	128 Å²	128	102.5 Å²	102.5	60%	0.598	52%	0.521	S	S	*	.	H	α-helix	trans	-65.9	-45.3	175.7	-71.8	176.7	-173	0	0	112.4	E244 I245 L246 N250 A251 L252	E244-E248 WeakPolarHBondContact O-CG 3.48Å; E244-E248 PolarHBondContact O-N 3.27Å; I245-E248 PolarHBondContact O-N 2.83Å; L246-E248 VanDerWaalsContact C-N 3.33Å; E248-N250 VanDerWaalsContact C-N 3.3Å; E248-N250 PolarHBondContact O-N 3.01Å; E248-A251 PolarHBondContact O-N 2.86Å; E248-L252 WeakPolarHBondContact O-CB 3.22Å; E248-L252 PolarHBondContact O-N 2.82Å
249	A	93.8	Very high	92.2	Very high	16 Å²	16	100 Å²	100	13%	0.132	51%	0.512	C	S	.	.	H	α-helix	trans	-59.7	-42.3	174.9	0	0	0	0	0	111.4	I227 V231 I245 L246 L252 C253	I227-A249 HydrophobicContact CG2-CB 4.3Å; V231-A249 HydrophobicContact CG2-CB 4.47Å; I245-A249 WeakPolarHBondContact O-CB 3.33Å; I245-A249 PolarHBondContact O-N 3.08Å; L246-A249 PolarHBondContact O-N 3.4Å; A249-L252 WeakPolarHBondContact O-CB 3.08Å; A249-L252 PolarHBondContact O-N 2.83Å; A249-C253 PolarHBondContact O-N 3.27Å; A249-C253 PolarHBondContact O-SG 3.07Å; A249-C253 VanDerWaalsContact O-SG 3.33Å
250	N	94	Very high	91.8	Very high	90 Å²	90	101 Å²	101	48%	0.481	52%	0.521	S	S	.	.	H	α-helix	trans	-64.1	-43.7	175.8	-172.5	45.7	0	0	0	112.1	L246 R247 E248 L252 C253 H254	L246-N250 VanDerWaalsContact O-CB 3.28Å; L246-N250 WeakPolarHBondContact O-CB 3.46Å; L246-N250 PolarHBondContact O-N 2.94Å; R247-N250 PolarHBondContact O-N 3.12Å; E248-N250 VanDerWaalsContact C-N 3.3Å; E248-N250 PolarHBondContact O-N 3.01Å; N250-L252 VanDerWaalsContact C-N 3.31Å; N250-L252 PolarHBondContact O-N 3.47Å; N250-C253 PolarHBondContact O-N 2.89Å; N250-H254 PolarHBondContact O-N 3.15Å; N250-H254 PolarHBondContact O-ND1 3.34Å; N250-H254 PolarHBondContact OD1-CE1 3.46Å; N250-H254 PolarHBondContact OD1-ND1 2.94Å; N250-H254 VanDerWaalsContact OD1-ND1 3.08Å
251	A	94.5	Very high	91.7	Very high	42 Å²	42	99.6 Å²	99.6	35%	0.347	51%	0.51	S	S	.	.	H	α-helix	trans	-62.5	-38.1	175.8	0	0	0	0	0	112	R247 E248 H254 R255	R247-A251 WeakPolarHBondContact O-CB 3.27Å; R247-A251 PolarHBondContact O-N 2.94Å; E248-A251 PolarHBondContact O-N 2.86Å; A251-H254 PolarHBondContact O-N 3.36Å; A251-R255 WeakPolarHBondContact O-CG 3.41Å; A251-R255 PolarHBondContact O-N 3.36Å
252	L	93.1	Very high	91.7	Very high	85 Å²	85	99.1 Å²	99.1	45%	0.445	52%	0.518	S	S	.	.	H	α-helix	trans	-61.6	-48.8	174.2	178.2	63.7	0	0	0	111.3	I227 E248 A249 N250 H254 R255	I227-L252 HydrophobicContact CD1-CD2 4.37Å; E248-L252 WeakPolarHBondContact O-CB 3.22Å; E248-L252 PolarHBondContact O-N 2.82Å; A249-L252 WeakPolarHBondContact O-CB 3.08Å; A249-L252 PolarHBondContact O-N 2.83Å; N250-L252 VanDerWaalsContact C-N 3.31Å; N250-L252 PolarHBondContact O-N 3.47Å; L252-H254 VanDerWaalsContact C-N 3.32Å; L252-H254 PolarHBondContact O-N 2.85Å; L252-R255 PolarHBondContact O-N 3.44Å
253	C	92.8	Very high	91.6	Very high	82 Å²	82	103.6 Å²	103.6	55%	0.554	54%	0.535	S	S	*	.	H	α-helix	trans	-59.5	-41.4	178.2	-69.8	0	0	0	0	112.5	A249 N250 R255 L256	A249-C253 PolarHBondContact O-N 3.27Å; A249-C253 PolarHBondContact O-SG 3.07Å; A249-C253 VanDerWaalsContact O-SG 3.33Å; N250-C253 PolarHBondContact O-N 2.89Å; C253-R255 VanDerWaalsContact C-N 3.26Å; C253-R255 PolarHBondContact O-N 3.43Å; C253-L256 WeakPolarHBondContact O-CB 3.31Å; C253-L256 PolarHBondContact O-N 3.49Å
254	H	91.4	Very high	91.6	Very high	143 Å²	143	100.8 Å²	100.8	66%	0.662	52%	0.521	S	S	*	.	H	α-helix	trans	-72.8	-15.6	-179.4	-76.7	80.6	0	0	0	114.1	N250 A251 L252 L256	N250-H254 PolarHBondContact O-N 3.15Å; N250-H254 PolarHBondContact O-ND1 3.34Å; N250-H254 PolarHBondContact OD1-CE1 3.46Å; N250-H254 PolarHBondContact OD1-ND1 2.94Å; N250-H254 VanDerWaalsContact OD1-ND1 3.08Å; A251-H254 PolarHBondContact O-N 3.36Å; L252-H254 VanDerWaalsContact C-N 3.32Å; L252-H254 PolarHBondContact O-N 2.85Å; H254-L256 VanDerWaalsContact C-N 3.27Å
255	R	90.4	Very high	91.7	Very high	186 Å²	186	100.2 Å²	100.2	70%	0.702	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-6.9	172.6	-74.4	171.6	176	175.1	-0.2	112.9	A251 L252 C253 P257 V258	A251-R255 WeakPolarHBondContact O-CG 3.41Å; A251-R255 PolarHBondContact O-N 3.36Å; L252-R255 PolarHBondContact O-N 3.44Å; C253-R255 VanDerWaalsContact C-N 3.26Å; C253-R255 PolarHBondContact O-N 3.43Å; R255-P257 CarbonylContact O-C 3.56Å; R255-P257 VanDerWaalsContact O-C 3.31Å; R255-V258 WeakPolarHBondContact O-CA 3.33Å; R255-V258 PolarHBondContact O-N 3.17Å
256	L	90	Very high	91.8	Very high	111 Å²	111	100.3 Å²	100.3	58%	0.581	52%	0.52	S	S	*	.			trans	-93.4	135	179.4	-59.8	175.2	0	0	0	110.4	C253 H254 V258	C253-L256 WeakPolarHBondContact O-CB 3.31Å; C253-L256 PolarHBondContact O-N 3.49Å; H254-L256 VanDerWaalsContact C-N 3.27Å; L256-V258 HydrophobicContact CD2-CG2 4.01Å
257	P	87.6	Confident	91.8	Very high	95 Å²	95	102.5 Å²	102.5	62%	0.617	53%	0.532	S	S	*	.	S	Bend	cis	-77	137.3	-4.8	30.7	-34	0	0	0	113.2	R255 L259	R255-P257 CarbonylContact O-C 3.56Å; R255-P257 VanDerWaalsContact O-C 3.31Å; P257-L259 VanDerWaalsContact C-N 3.33Å; P257-L259 PolarHBondContact O-N 2.63Å
258	V	84.5	Confident	91.8	Very high	118 Å²	118	98.7 Å²	98.7	72%	0.715	52%	0.521	S	S	*	.	S	Bend	trans	-56.8	-40.5	-170.5	-175.8	0	0	0	0	113.4	R255 L256	R255-V258 WeakPolarHBondContact O-CA 3.33Å; R255-V258 PolarHBondContact O-N 3.17Å; L256-V258 HydrophobicContact CD2-CG2 4.01Å
259	L	84.3	Confident	91.9	Very high	108 Å²	108	99.6 Å²	99.6	57%	0.565	52%	0.52	S	S	*	.			trans	-137.2	116.4	176.6	-71.2	171.3	0	0	0	109.2	P257 F264	P257-L259 VanDerWaalsContact C-N 3.33Å; P257-L259 PolarHBondContact O-N 2.63Å; L259-F264 HydrophobicContact CB-CD1 4.24Å; L259-F264 HydrophobicContact CB-CD2 4.43Å; L259-F264 HydrophobicContact CB-CE1 4.44Å; L259-F264 HydrophobicContact CB-CG 4.24Å; L259-F264 HydrophobicContact CD1-CD2 4.25Å; L259-F264 HydrophobicContact CD1-CE2 4.25Å
260	S	85.9	Confident	92	Very high	72 Å²	72	102.6 Å²	102.6	50%	0.503	53%	0.533	S	S	.	.			trans	-135.6	13.2	178.9	57.7	0	0	0	0	113.3
261	T	92	Very high	92.1	Very high	80 Å²	80	104.4 Å²	104.4	49%	0.491	54%	0.539	S	S	.	.			trans	-67.6	150.7	-177.2	68.2	0	0	0	0	111.5	K263 F264 K265	T261-K263 VanDerWaalsContact C-N 3.29Å; T261-K263 PolarHBondContact O-N 2.77Å; T261-F264 PolarHBondContact O-N 3.13Å; T261-F264 WeakPolarHBondContact OG1-CB 3.44Å; T261-F264 PolarHBondContact OG1-N 3.43Å; T261-K265 PolarHBondContact O-N 2.91Å
262	T	92.7	Very high	92.2	Very high	115 Å²	115	105.1 Å²	105.1	71%	0.706	54%	0.541	S	S	*	.	H	α-helix	trans	-61.2	-39.5	178	-47	0	0	0	0	111.7	F264 K265 T266	T262-F264 PolarHBondContact O-N 3.11Å; T262-K265 WeakPolarHBondContact O-CB 3.4Å; T262-K265 PolarHBondContact O-N 3.35Å; T262-K265 VanDerWaalsContact O-N 3.17Å; T262-T266 PolarHBondContact O-N 3.29Å; T262-T266 PolarHBondContact O-OG1 2.62Å
263	K	94	Very high	92.4	Very high	150 Å²	150	106 Å²	106	65%	0.652	55%	0.546	S	S	*	.	H	α-helix	trans	-58.7	-46.7	176	-175.3	179.6	177.1	-177.3	0	111.6	T261 K265 T266 D267	T261-K263 VanDerWaalsContact C-N 3.29Å; T261-K263 PolarHBondContact O-N 2.77Å; K263-K265 VanDerWaalsContact C-N 3.28Å; K263-K265 PolarHBondContact O-N 3.26Å; K263-T266 PolarHBondContact O-N 2.9Å; K263-T266 VanDerWaalsContact O-N 3.16Å; K263-D267 VanDerWaalsContact O-CG 3.25Å; K263-D267 PolarHBondContact O-N 2.77Å
264	F	93.4	Very high	92.6	Very high	85 Å²	85	107.3 Å²	107.3	37%	0.373	55%	0.547	S	S	.	.	H	α-helix	trans	-58.6	-40.2	176.7	172.2	-102.7	0	0	0	112.1	L259 T261 T262 D267 F268	L259-F264 HydrophobicContact CB-CD1 4.24Å; L259-F264 HydrophobicContact CB-CD2 4.43Å; L259-F264 HydrophobicContact CB-CE1 4.44Å; L259-F264 HydrophobicContact CB-CG 4.24Å; L259-F264 HydrophobicContact CD1-CD2 4.25Å; L259-F264 HydrophobicContact CD1-CE2 4.25Å; T261-F264 PolarHBondContact O-N 3.13Å; T261-F264 WeakPolarHBondContact OG1-CB 3.44Å; T261-F264 PolarHBondContact OG1-N 3.43Å; T262-F264 PolarHBondContact O-N 3.11Å; F264-D267 PolarHBondContact O-N 3.36Å; F264-F268 WeakPolarHBondContact O-CB 3.26Å; F264-F268 PolarHBondContact O-N 3.49Å
265	K	93.6	Very high	92.9	Very high	118 Å²	118	104.8 Å²	104.8	51%	0.513	54%	0.542	S	S	.	.	H	α-helix	trans	-64	-43.7	176.6	-67.4	-179.1	-177.4	178.9	0	111.9	T261 T262 K263 F268 Y269	T261-K265 PolarHBondContact O-N 2.91Å; T262-K265 WeakPolarHBondContact O-CB 3.4Å; T262-K265 PolarHBondContact O-N 3.35Å; T262-K265 VanDerWaalsContact O-N 3.17Å; K263-K265 VanDerWaalsContact C-N 3.28Å; K263-K265 PolarHBondContact O-N 3.26Å; K265-F268 PolarHBondContact O-N 2.85Å; K265-Y269 WeakPolarHBondContact O-CD2 3.18Å; K265-Y269 PolarHBondContact O-N 3.37Å
266	T	95.7	Very high	93.2	Very high	72 Å²	72	97.8 Å²	97.8	44%	0.442	53%	0.528	S	S	.	.	H	α-helix	trans	-59.5	-54.1	175.3	-59.2	0	0	0	0	110.6	T262 K263 F268 Y269 D270	T262-T266 PolarHBondContact O-N 3.29Å; T262-T266 PolarHBondContact O-OG1 2.62Å; K263-T266 PolarHBondContact O-N 2.9Å; K263-T266 VanDerWaalsContact O-N 3.16Å; T266-F268 PolarHBondContact O-N 3.5Å; T266-Y269 PolarHBondContact O-N 2.93Å; T266-D270 PolarHBondContact O-N 3.41Å
267	D	94.9	Very high	93.5	Very high	80 Å²	80	97.4 Å²	97.4	43%	0.428	53%	0.526	S	S	.	.	H	α-helix	trans	-57.8	-37.4	179.6	-61.4	-11.6	0	0	0	111.5	K263 F264 D270 Q271	K263-D267 VanDerWaalsContact O-CG 3.25Å; K263-D267 PolarHBondContact O-N 2.77Å; F264-D267 PolarHBondContact O-N 3.36Å; D267-D270 PolarHBondContact O-N 3.43Å; D267-Q271 PolarHBondContact O-N 2.98Å
268	F	94.4	Very high	94	Very high	97 Å²	97	99.7 Å²	99.7	43%	0.425	53%	0.53	S	S	.	.	H	α-helix	trans	-65.6	-43.5	175.9	177.2	-98.3	0	0	0	112.9	F264 K265 T266 Q271 C272	F264-F268 WeakPolarHBondContact O-CB 3.26Å; F264-F268 PolarHBondContact O-N 3.49Å; K265-F268 PolarHBondContact O-N 2.85Å; T266-F268 PolarHBondContact O-N 3.5Å; F268-Q271 PolarHBondContact O-N 2.89Å; F268-C272 PolarHBondContact O-N 3.02Å; F268-C272 PolarHBondContact O-SG 3.15Å
269	Y	95.9	Very high	94.5	Very high	147 Å²	147	96.8 Å²	96.8	58%	0.576	52%	0.518	S	S	*	.	H	α-helix	trans	-69	-37.2	176.5	-80	-64.1	0	0	0	111.9	K265 T266 C272 N273	K265-Y269 WeakPolarHBondContact O-CD2 3.18Å; K265-Y269 PolarHBondContact O-N 3.37Å; T266-Y269 PolarHBondContact O-N 2.93Å; Y269-C272 WeakPolarHBondContact O-CB 3.36Å; Y269-C272 PolarHBondContact O-N 3.37Å; Y269-N273 WeakPolarHBondContact O-CB 3.14Å; Y269-N273 PolarHBondContact O-N 3Å; Y269-N273 PolarHBondContact O-ND2 3.48Å; Y269-N273 VanDerWaalsContact O-ND2 3.13Å
270	D	96.8	Very high	95.1	Very high	79 Å²	79	98.7 Å²	98.7	42%	0.422	52%	0.519	S	S	.	.	H	α-helix	trans	-60.6	-47	175	-68.5	-17.9	0	0	0	110.4	T266 D267 C272 N273 D274	T266-D270 PolarHBondContact O-N 3.41Å; D267-D270 PolarHBondContact O-N 3.43Å; D270-C272 VanDerWaalsContact C-N 3.33Å; D270-C272 PolarHBondContact O-N 3.49Å; D270-N273 PolarHBondContact O-N 3.08Å; D270-D274 PolarHBondContact O-N 3.04Å
271	Q	96.6	Very high	95.6	Very high	127 Å²	127	99.8 Å²	99.8	59%	0.593	52%	0.519	S	S	*	.	H	α-helix	trans	-59.3	-41.9	174	-171.8	179.1	19.4	0	0	112.5	D267 F268 D274 V275	D267-Q271 PolarHBondContact O-N 2.98Å; F268-Q271 PolarHBondContact O-N 2.89Å; Q271-D274 PolarHBondContact O-N 3.26Å; Q271-V275 HydrophobicContact CG-CG2 4.49Å; Q271-V275 WeakPolarHBondContact O-CB 3.22Å; Q271-V275 VanDerWaalsContact O-CG2 3.3Å; Q271-V275 WeakPolarHBondContact O-CG2 3.48Å; Q271-V275 PolarHBondContact O-N 2.84Å
272	C	96.1	Very high	95.9	Very high	58 Å²	58	98 Å²	98	39%	0.392	52%	0.515	S	S	.	.	H	α-helix	trans	-63.9	-40.6	177.6	-73.3	0	0	0	0	112.2	F268 Y269 D270 G276	F268-C272 PolarHBondContact O-N 3.02Å; F268-C272 PolarHBondContact O-SG 3.15Å; Y269-C272 WeakPolarHBondContact O-CB 3.36Å; Y269-C272 PolarHBondContact O-N 3.37Å; D270-C272 VanDerWaalsContact C-N 3.33Å; D270-C272 PolarHBondContact O-N 3.49Å; C272-G276 PolarHBondContact O-N 2.92Å
273	N	97.1	Very high	96.1	Very high	103 Å²	103	95.9 Å²	95.9	55%	0.551	50%	0.503	S	S	*	.	H	α-helix	trans	-65.6	-44.5	177.4	-70.8	-32.9	0	0	0	111.2	Y269 D270 G276 L277	Y269-N273 WeakPolarHBondContact O-CB 3.14Å; Y269-N273 PolarHBondContact O-N 3Å; Y269-N273 PolarHBondContact O-ND2 3.48Å; Y269-N273 VanDerWaalsContact O-ND2 3.13Å; D270-N273 PolarHBondContact O-N 3.08Å; N273-G276 PolarHBondContact O-N 3.08Å; N273-L277 VanDerWaalsContact O-CB 3.31Å; N273-L277 WeakPolarHBondContact O-CB 3.31Å; N273-L277 PolarHBondContact O-N 2.94Å
274	D	97.4	Very high	96.3	Very high	109 Å²	109	92.5 Å²	92.5	58%	0.583	49%	0.491	S	S	*	.	H	α-helix	trans	-63.7	-47.6	179.1	-74.6	-13.9	0	0	0	112	D270 Q271 G276 L277 M278	D270-D274 PolarHBondContact O-N 3.04Å; Q271-D274 PolarHBondContact O-N 3.26Å; D274-G276 VanDerWaalsContact C-N 3.35Å; D274-G276 PolarHBondContact O-N 3.39Å; D274-L277 PolarHBondContact O-N 3.3Å; D274-M278 WeakPolarHBondContact O-CB 3.48Å; D274-M278 PolarHBondContact O-N 2.9Å
275	V	96.6	Very high	96.4	Very high	91 Å²	91	93.1 Å²	93.1	55%	0.552	50%	0.502	S	S	*	.	H	α-helix	trans	-63.6	-42.7	176.5	173.5	0	0	0	0	110.6	Q271 M278 A279	Q271-V275 HydrophobicContact CG-CG2 4.49Å; Q271-V275 WeakPolarHBondContact O-CB 3.22Å; Q271-V275 VanDerWaalsContact O-CG2 3.3Å; Q271-V275 WeakPolarHBondContact O-CG2 3.48Å; Q271-V275 PolarHBondContact O-N 2.84Å; V275-M278 PolarHBondContact O-N 2.92Å; V275-A279 VanDerWaalsContact O-CB 3.26Å; V275-A279 WeakPolarHBondContact O-CB 3.28Å; V275-A279 PolarHBondContact O-N 3.31Å
276	G	96.9	Very high	96.6	Very high	39 Å²	39	94.8 Å²	94.8	40%	0.402	51%	0.509	S	S	.	.	H	α-helix	trans	-61.6	-44.9	177.7	0	0	0	0	0	112.5	C272 N273 D274 Y280	C272-G276 PolarHBondContact O-N 2.92Å; N273-G276 PolarHBondContact O-N 3.08Å; D274-G276 VanDerWaalsContact C-N 3.35Å; D274-G276 PolarHBondContact O-N 3.39Å; G276-Y280 VanDerWaalsContact O-CB 3.28Å; G276-Y280 WeakPolarHBondContact O-CB 3.4Å; G276-Y280 PolarHBondContact O-N 2.93Å
277	L	97.5	Very high	96.7	Very high	103 Å²	103	95.9 Å²	95.9	54%	0.539	52%	0.516	S	S	.	.	H	α-helix	trans	-62.8	-47.4	176.9	178.3	60.8	0	0	0	111.4	N273 D274 Y280 L281	N273-L277 VanDerWaalsContact O-CB 3.31Å; N273-L277 WeakPolarHBondContact O-CB 3.31Å; N273-L277 PolarHBondContact O-N 2.94Å; D274-L277 PolarHBondContact O-N 3.3Å; L277-Y280 PolarHBondContact O-N 3.49Å; L277-L281 HydrophobicContact CD1-CD1 4.44Å; L277-L281 HydrophobicContact CD1-CG 4.46Å; L277-L281 HydrophobicContact CG-CD1 4.33Å; L277-L281 WeakPolarHBondContact O-CG 3.36Å; L277-L281 PolarHBondContact O-N 3.04Å
278	M	96.9	Very high	96.8	Very high	143 Å²	143	95.6 Å²	95.6	70%	0.704	52%	0.519	S	S	*	.	H	α-helix	trans	-63.9	-43.7	179.4	-170.3	-178.4	-62.5	0	0	111.9	D274 V275 Y280 L281 G282	D274-M278 WeakPolarHBondContact O-CB 3.48Å; D274-M278 PolarHBondContact O-N 2.9Å; V275-M278 PolarHBondContact O-N 2.92Å; M278-Y280 VanDerWaalsContact C-N 3.34Å; M278-Y280 PolarHBondContact O-N 2.76Å; M278-L281 PolarHBondContact O-N 3.38Å; M278-G282 PolarHBondContact O-N 3.17Å
279	A	95.8	Very high	97	Very high	57 Å²	57	95 Å²	95	47%	0.471	52%	0.521	S	S	.	.	H	α-helix	trans	-61.6	-43.6	175.4	0	0	0	0	0	111.2	V275 G282 T283	V275-A279 VanDerWaalsContact O-CB 3.26Å; V275-A279 WeakPolarHBondContact O-CB 3.28Å; V275-A279 PolarHBondContact O-N 3.31Å; A279-G282 PolarHBondContact O-N 2.98Å; A279-T283 WeakPolarHBondContact O-CG2 3.41Å; A279-T283 PolarHBondContact O-N 2.87Å
280	Y	97.2	Very high	97	Very high	148 Å²	148	91 Å²	91	58%	0.58	51%	0.514	S	S	*	.	H	α-helix	trans	-62.7	-44.8	177.9	-174.3	-119.7	0	0	0	112	G276 L277 M278 G282 T283 I284	G276-Y280 VanDerWaalsContact O-CB 3.28Å; G276-Y280 WeakPolarHBondContact O-CB 3.4Å; G276-Y280 PolarHBondContact O-N 2.93Å; L277-Y280 PolarHBondContact O-N 3.49Å; M278-Y280 VanDerWaalsContact C-N 3.34Å; M278-Y280 PolarHBondContact O-N 2.76Å; Y280-G282 VanDerWaalsContact C-N 3.3Å; Y280-G282 PolarHBondContact O-N 3.12Å; Y280-T283 WeakPolarHBondContact CA-OG1 3.34Å; Y280-T283 PolarHBondContact O-N 3.37Å; Y280-T283 PolarHBondContact O-OG1 3.37Å; Y280-I284 HydrophobicContact CD1-CD1 3.85Å; Y280-I284 HydrophobicContact CE1-CD1 3.53Å; Y280-I284 HydrophobicContact CE1-CG1 4.3Å; Y280-I284 WeakPolarHBondContact O-CG1 3.5Å; Y280-I284 PolarHBondContact O-N 2.64Å
281	L	97.2	Very high	97.1	Very high	95 Å²	95	92.5 Å²	92.5	50%	0.497	52%	0.52	S	S	.	.	H	α-helix	trans	-56.8	-43.9	172.4	-71.6	171.1	0	0	0	111.6	L277 M278 T283 I284 T285	L277-L281 HydrophobicContact CD1-CD1 4.44Å; L277-L281 HydrophobicContact CD1-CG 4.46Å; L277-L281 HydrophobicContact CG-CD1 4.33Å; L277-L281 WeakPolarHBondContact O-CG 3.36Å; L277-L281 PolarHBondContact O-N 3.04Å; M278-L281 PolarHBondContact O-N 3.38Å; L281-T283 VanDerWaalsContact C-N 3.32Å; L281-T283 PolarHBondContact O-N 3.42Å; L281-I284 WeakPolarHBondContact O-CB 3.45Å; L281-I284 PolarHBondContact O-N 2.93Å; L281-I284 VanDerWaalsContact O-N 3.17Å; L281-T285 PolarHBondContact O-N 3.17Å; L281-T285 PolarHBondContact O-OG1 2.94Å; L281-T285 VanDerWaalsContact O-OG1 3.09Å
282	G	96.6	Very high	97	Very high	41 Å²	41	90.3 Å²	90.3	42%	0.423	51%	0.513	S	S	.	.	H	α-helix	trans	-58.8	-39.2	173.2	0	0	0	0	0	113.5	M278 A279 Y280 T285 K286	M278-G282 PolarHBondContact O-N 3.17Å; A279-G282 PolarHBondContact O-N 2.98Å; Y280-G282 VanDerWaalsContact C-N 3.3Å; Y280-G282 PolarHBondContact O-N 3.12Å; G282-T285 PolarHBondContact O-N 2.78Å; G282-K286 PolarHBondContact O-N 2.87Å
283	T	97.1	Very high	97.1	Very high	72 Å²	72	92 Å²	92	44%	0.442	52%	0.515	S	S	.	.	H	α-helix	trans	-68	-35.6	175.3	65.9	0	0	0	0	112.8	A279 Y280 L281 K286 T287	A279-T283 WeakPolarHBondContact O-CG2 3.41Å; A279-T283 PolarHBondContact O-N 2.87Å; Y280-T283 WeakPolarHBondContact CA-OG1 3.34Å; Y280-T283 PolarHBondContact O-N 3.37Å; Y280-T283 PolarHBondContact O-OG1 3.37Å; L281-T283 VanDerWaalsContact C-N 3.32Å; L281-T283 PolarHBondContact O-N 3.42Å; T283-K286 PolarHBondContact O-N 3.09Å; T283-T287 WeakPolarHBondContact O-CB 3.48Å; T283-T287 PolarHBondContact O-N 3.41Å; T283-T287 PolarHBondContact O-OG1 2.93Å
284	I	97.8	Very high	97	Very high	78 Å²	78	93.5 Å²	93.5	40%	0.4	52%	0.517	S	S	.	.	H	α-helix	trans	-64.4	-46	172.9	-67.8	168.6	0	0	0	109.7	Y280 L281 K286 T287 C288	Y280-I284 HydrophobicContact CD1-CD1 3.85Å; Y280-I284 HydrophobicContact CE1-CD1 3.53Å; Y280-I284 HydrophobicContact CE1-CG1 4.3Å; Y280-I284 WeakPolarHBondContact O-CG1 3.5Å; Y280-I284 PolarHBondContact O-N 2.64Å; L281-I284 WeakPolarHBondContact O-CB 3.45Å; L281-I284 PolarHBondContact O-N 2.93Å; L281-I284 VanDerWaalsContact O-N 3.17Å; I284-K286 VanDerWaalsContact C-N 3.33Å; I284-K286 PolarHBondContact O-N 2.85Å; I284-T287 WeakPolarHBondContact O-CB 3.41Å; I284-T287 PolarHBondContact O-N 3.15Å; I284-T287 VanDerWaalsContact O-N 3.15Å; I284-C288 PolarHBondContact O-N 2.86Å
285	T	97.4	Very high	96.9	Very high	99 Å²	99	91.6 Å²	91.6	61%	0.607	51%	0.506	S	S	*	.	H	α-helix	trans	-58.3	-45.4	175.9	-55.5	0	0	0	0	111.4	L281 G282 T287 C288 N289	L281-T285 PolarHBondContact O-N 3.17Å; L281-T285 PolarHBondContact O-OG1 2.94Å; L281-T285 VanDerWaalsContact O-OG1 3.09Å; G282-T285 PolarHBondContact O-N 2.78Å; T285-T287 VanDerWaalsContact C-N 3.35Å; T285-T287 PolarHBondContact O-N 3.47Å; T285-C288 PolarHBondContact O-N 2.97Å; T285-N289 PolarHBondContact O-N 3.34Å
286	K	97.1	Very high	96.8	Very high	152 Å²	152	91.4 Å²	91.4	66%	0.661	50%	0.501	S	S	*	.	H	α-helix	trans	-61.3	-42.7	175.3	-172.5	177	179.4	178.8	0	111.9	G282 T283 I284 N289 S290	G282-K286 PolarHBondContact O-N 2.87Å; T283-K286 PolarHBondContact O-N 3.09Å; I284-K286 VanDerWaalsContact C-N 3.33Å; I284-K286 PolarHBondContact O-N 2.85Å; K286-N289 WeakPolarHBondContact O-CB 3.43Å; K286-N289 PolarHBondContact O-N 2.84Å; K286-S290 PolarHBondContact O-N 3.25Å; K286-S290 PolarHBondContact O-OG 3.46Å
287	T	97.8	Very high	96.7	Very high	95 Å²	95	96.1 Å²	96.1	58%	0.583	51%	0.511	S	S	*	.	H	α-helix	trans	-61.7	-45.1	177	-58.8	0	0	0	0	111.5	T283 I284 T285 N289 S290 M291	T283-T287 WeakPolarHBondContact O-CB 3.48Å; T283-T287 PolarHBondContact O-N 3.41Å; T283-T287 PolarHBondContact O-OG1 2.93Å; I284-T287 WeakPolarHBondContact O-CB 3.41Å; I284-T287 PolarHBondContact O-N 3.15Å; I284-T287 VanDerWaalsContact O-N 3.15Å; T285-T287 VanDerWaalsContact C-N 3.35Å; T285-T287 PolarHBondContact O-N 3.47Å; T287-N289 VanDerWaalsContact C-N 3.34Å; T287-N289 PolarHBondContact O-N 2.89Å; T287-S290 PolarHBondContact O-N 3.28Å; T287-M291 WeakPolarHBondContact O-CB 3.49Å; T287-M291 PolarHBondContact O-N 3.27Å
288	C	97.3	Very high	96.5	Very high	74 Å²	74	95.6 Å²	95.6	50%	0.5	50%	0.504	S	S	.	.	H	α-helix	trans	-61.2	-42.3	176	-172.1	0	0	0	0	111.6	I284 T285 M291 N292	I284-C288 PolarHBondContact O-N 2.86Å; T285-C288 PolarHBondContact O-N 2.97Å; C288-M291 PolarHBondContact O-N 2.88Å; C288-N292 WeakPolarHBondContact O-CB 3.44Å; C288-N292 PolarHBondContact O-N 3.31Å
289	N	97.4	Very high	96.3	Very high	85 Å²	85	92 Å²	92	46%	0.455	49%	0.488	S	S	.	.	H	α-helix	trans	-62.1	-46	174.3	-176.5	38.7	0	0	0	112	T285 K286 T287 M291 N292 Q293	T285-N289 PolarHBondContact O-N 3.34Å; K286-N289 WeakPolarHBondContact O-CB 3.43Å; K286-N289 PolarHBondContact O-N 2.84Å; T287-N289 VanDerWaalsContact C-N 3.34Å; T287-N289 PolarHBondContact O-N 2.89Å; N289-M291 VanDerWaalsContact C-N 3.32Å; N289-M291 PolarHBondContact O-N 3.39Å; N289-N292 PolarHBondContact O-N 2.89Å; N289-Q293 WeakPolarHBondContact O-CG 3.43Å; N289-Q293 PolarHBondContact O-N 3.15Å
290	S	97.3	Very high	96	Very high	63 Å²	63	95.2 Å²	95.2	44%	0.441	50%	0.502	S	S	.	.	H	α-helix	trans	-62.2	-38.3	175.7	-66.9	0	0	0	0	112.5	K286 T287 Q293 F294	K286-S290 PolarHBondContact O-N 3.25Å; K286-S290 PolarHBondContact O-OG 3.46Å; T287-S290 PolarHBondContact O-N 3.28Å; S290-Q293 PolarHBondContact O-N 2.9Å; S290-F294 WeakPolarHBondContact O-CB 3.35Å; S290-F294 PolarHBondContact O-N 3.5Å
291	M	97.3	Very high	95.6	Very high	110 Å²	110	94.4 Å²	94.4	54%	0.542	51%	0.507	S	S	.	.	H	α-helix	trans	-64.3	-44.1	174.3	-171.3	178	81.1	0	0	111.3	T287 C288 N289 Q293 F294 I295	T287-M291 WeakPolarHBondContact O-CB 3.49Å; T287-M291 PolarHBondContact O-N 3.27Å; C288-M291 PolarHBondContact O-N 2.88Å; N289-M291 VanDerWaalsContact C-N 3.32Å; N289-M291 PolarHBondContact O-N 3.39Å; M291-Q293 PolarHBondContact O-N 3.07Å; M291-F294 WeakPolarHBondContact O-CB 3.47Å; M291-F294 PolarHBondContact O-N 2.88Å; M291-I295 HydrophobicContact CE-CD1 4.5Å; M291-I295 HydrophobicContact CG-CD1 4.14Å; M291-I295 WeakPolarHBondContact O-CG1 3.38Å; M291-I295 PolarHBondContact O-N 3.24Å
292	N	96.2	Very high	94.8	Very high	82 Å²	82	97.8 Å²	97.8	44%	0.439	51%	0.514	S	S	.	.	H	α-helix	trans	-61.3	-44.8	175.1	-170.9	11.8	0	0	0	111.3	C288 N289 F294 I295 N296	C288-N292 WeakPolarHBondContact O-CB 3.44Å; C288-N292 PolarHBondContact O-N 3.31Å; N289-N292 PolarHBondContact O-N 2.89Å; N292-F294 VanDerWaalsContact C-N 3.3Å; N292-F294 PolarHBondContact O-N 2.81Å; N292-I295 PolarHBondContact O-N 3.06Å; N292-N296 WeakPolarHBondContact O-CB 3.45Å; N292-N296 VanDerWaalsContact O-CG 3.26Å; N292-N296 PolarHBondContact O-N 3.19Å; N292-N296 PolarHBondContact O-ND2 3.43Å; N292-N296 VanDerWaalsContact O-ND2 3.07Å; N292-N296 PolarHBondContact OD1-ND2 2.9Å; N292-N296 VanDerWaalsContact OD1-ND2 3.15Å
293	Q	96.4	Very high	93.2	Very high	94 Å²	94	99 Å²	99	44%	0.439	51%	0.511	S	S	.	.	H	α-helix	trans	-59.4	-40.1	173.8	-72.1	-177.3	7	0	0	112.5	N289 S290 M291 K297	N289-Q293 WeakPolarHBondContact O-CG 3.43Å; N289-Q293 PolarHBondContact O-N 3.15Å; S290-Q293 PolarHBondContact O-N 2.9Å; M291-Q293 PolarHBondContact O-N 3.07Å; Q293-K297 WeakPolarHBondContact O-CG 3.46Å; Q293-K297 PolarHBondContact O-N 3.29Å
294	F	95.9	Very high	91.6	Very high	134 Å²	134	105.5 Å²	105.5	59%	0.588	53%	0.527	S	S	*	.	H	α-helix	trans	-63.2	-49.5	175.3	171.3	-98.5	0	0	0	111.5	S290 M291 N292 N296 K297 F298	S290-F294 WeakPolarHBondContact O-CB 3.35Å; S290-F294 PolarHBondContact O-N 3.5Å; M291-F294 WeakPolarHBondContact O-CB 3.47Å; M291-F294 PolarHBondContact O-N 2.88Å; N292-F294 VanDerWaalsContact C-N 3.3Å; N292-F294 PolarHBondContact O-N 2.81Å; F294-N296 VanDerWaalsContact C-N 3.31Å; F294-N296 PolarHBondContact O-N 3.4Å; F294-K297 PolarHBondContact O-N 3.21Å; F294-F298 HydrophobicContact CZ-CD2 4.43Å; F294-F298 WeakPolarHBondContact O-CB 3.35Å; F294-F298 PolarHBondContact O-N 3.38Å
295	I	95.2	Very high	89.6	Confident	69 Å²	69	109.6 Å²	109.6	35%	0.354	55%	0.545	S	S	.	.	H	α-helix	trans	-59	-44.4	178.2	-68.1	166.8	0	0	0	110.5	M291 N292 K297 F298 N299	M291-I295 HydrophobicContact CE-CD1 4.5Å; M291-I295 HydrophobicContact CG-CD1 4.14Å; M291-I295 WeakPolarHBondContact O-CG1 3.38Å; M291-I295 PolarHBondContact O-N 3.24Å; N292-I295 PolarHBondContact O-N 3.06Å; I295-K297 PolarHBondContact O-N 3.48Å; I295-F298 PolarHBondContact O-N 3.2Å; I295-N299 WeakPolarHBondContact O-CB 3.38Å; I295-N299 PolarHBondContact O-N 2.85Å; I295-N299 PolarHBondContact O-ND2 3.24Å
296	N	94.3	Very high	87.6	Confident	86 Å²	86	108.4 Å²	108.4	46%	0.46	55%	0.552	S	S	.	*	H	α-helix	trans	-59.6	-45.9	177.2	-72.3	-35.1	0	0	0	112	N292 F294 N299 V300	N292-N296 WeakPolarHBondContact O-CB 3.45Å; N292-N296 VanDerWaalsContact O-CG 3.26Å; N292-N296 PolarHBondContact O-N 3.19Å; N292-N296 PolarHBondContact O-ND2 3.43Å; N292-N296 VanDerWaalsContact O-ND2 3.07Å; N292-N296 PolarHBondContact OD1-ND2 2.9Å; N292-N296 VanDerWaalsContact OD1-ND2 3.15Å; F294-N296 VanDerWaalsContact C-N 3.31Å; F294-N296 PolarHBondContact O-N 3.4Å; N296-N299 PolarHBondContact O-N 3.47Å; N296-V300 WeakPolarHBondContact O-CG2 3.35Å; N296-V300 PolarHBondContact O-N 3.44Å
297	K	94.1	Very high	85.5	Confident	139 Å²	139	108.5 Å²	108.5	60%	0.604	56%	0.558	S	S	*	*	H	α-helix	trans	-66	-39.6	176.3	-71.9	177.7	-178.7	-179.4	0	112.1	Q293 F294 I295 V300 L301	Q293-K297 WeakPolarHBondContact O-CG 3.46Å; Q293-K297 PolarHBondContact O-N 3.29Å; F294-K297 PolarHBondContact O-N 3.21Å; I295-K297 PolarHBondContact O-N 3.48Å; K297-V300 PolarHBondContact O-N 3.21Å; K297-L301 WeakPolarHBondContact O-CG 3.45Å; K297-L301 PolarHBondContact O-N 3.38Å; K297-L301 VanDerWaalsContact O-N 3.1Å
298	F	94.3	Very high	83.3	Confident	92 Å²	92	107.5 Å²	107.5	40%	0.404	57%	0.566	S	S	.	*	H	α-helix	trans	-62.5	-45.7	177.4	-178.1	-91.7	0	0	0	111.3	F294 I295 V300 L301 Y302 D303	F294-F298 HydrophobicContact CZ-CD2 4.43Å; F294-F298 WeakPolarHBondContact O-CB 3.35Å; F294-F298 PolarHBondContact O-N 3.38Å; I295-F298 PolarHBondContact O-N 3.2Å; F298-V300 VanDerWaalsContact C-N 3.3Å; F298-V300 PolarHBondContact O-N 3.1Å; F298-L301 PolarHBondContact O-N 3.27Å; F298-Y302 AromaticContact CD2-CD2 3.63Å; F298-Y302 HydrophobicContact CD2-CD2 3.63Å; F298-Y302 HydrophobicContact CD2-CE2 4.4Å; F298-Y302 HydrophobicContact CD2-CG 4.11Å; F298-Y302 AromaticContact CE2-CD2 3.75Å; F298-Y302 HydrophobicContact CE2-CD2 3.75Å; F298-Y302 AromaticContact CE2-CG 3.79Å; F298-Y302 HydrophobicContact CE2-CG 3.79Å; F298-Y302 HydrophobicContact CG-CD2 4.38Å; F298-Y302 HydrophobicContact CZ-CG 4.24Å; F298-Y302 WeakPolarHBondContact O-CB 3.45Å; F298-Y302 PolarHBondContact O-N 2.79Å; F298-D303 PolarHBondContact O-N 3.46Å
299	N	91.8	Very high	81	Confident	68 Å²	68	115.4 Å²	115.4	36%	0.364	59%	0.586	S	S	.	*	H	α-helix	trans	-62.9	-36.8	178.7	-69	-13.3	0	0	0	112	I295 N296 D303	I295-N299 WeakPolarHBondContact O-CB 3.38Å; I295-N299 PolarHBondContact O-N 2.85Å; I295-N299 PolarHBondContact O-ND2 3.24Å; N296-N299 PolarHBondContact O-N 3.47Å; N299-D303 HydrophobicContact CB-CB 4.27Å; N299-D303 WeakPolarHBondContact O-CB 3.23Å; N299-D303 PolarHBondContact O-N 3.37Å
300	V	90.6	Very high	78.8	Confident	124 Å²	124	123 Å²	123	75%	0.752	61%	0.608	S	S	*	*	H	α-helix	trans	-67	-40.8	175.5	171.6	0	0	0	0	112.2	N296 K297 F298	N296-V300 WeakPolarHBondContact O-CG2 3.35Å; N296-V300 PolarHBondContact O-N 3.44Å; K297-V300 PolarHBondContact O-N 3.21Å; F298-V300 VanDerWaalsContact C-N 3.3Å; F298-V300 PolarHBondContact O-N 3.1Å
301	L	88.7	Confident	76.5	Confident	131 Å²	131	129.1 Å²	129.1	69%	0.686	63%	0.632	S	S	*	*	H	α-helix	trans	-88.8	-40.2	-172.6	-69	176.6	0	0	0	114	K297 F298	K297-L301 WeakPolarHBondContact O-CG 3.45Å; K297-L301 PolarHBondContact O-N 3.38Å; K297-L301 VanDerWaalsContact O-N 3.1Å; F298-L301 PolarHBondContact O-N 3.27Å
302	Y	80	Confident	73.9	Confident	166 Å²	166	136 Å²	136	65%	0.651	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.3	-31.3	-168.9	-70.9	-82.3	0	0	0	113.2	F298 R304	F298-Y302 AromaticContact CD2-CD2 3.63Å; F298-Y302 HydrophobicContact CD2-CD2 3.63Å; F298-Y302 HydrophobicContact CD2-CE2 4.4Å; F298-Y302 HydrophobicContact CD2-CG 4.11Å; F298-Y302 AromaticContact CE2-CD2 3.75Å; F298-Y302 HydrophobicContact CE2-CD2 3.75Å; F298-Y302 AromaticContact CE2-CG 3.79Å; F298-Y302 HydrophobicContact CE2-CG 3.79Å; F298-Y302 HydrophobicContact CG-CD2 4.38Å; F298-Y302 HydrophobicContact CZ-CG 4.24Å; F298-Y302 WeakPolarHBondContact O-CB 3.45Å; F298-Y302 PolarHBondContact O-N 2.79Å; Y302-R304 VanDerWaalsContact C-N 3.33Å; Y302-R304 PolarHBondContact O-N 3Å
303	D	64.1	Low	71.2	Confident	67 Å²	67	135.4 Å²	135.4	36%	0.358	67%	0.665	S	S	.	*			trans	-80.9	84.5	178.3	-158	17.4	0	0	0	110	F298 N299 Q305	F298-D303 PolarHBondContact O-N 3.46Å; N299-D303 HydrophobicContact CB-CB 4.27Å; N299-D303 WeakPolarHBondContact O-CB 3.23Å; N299-D303 PolarHBondContact O-N 3.37Å; D303-Q305 PolarHBondContact O-N 3.34Å; D303-Q305 VanDerWaalsContact OD1-CG 3.23Å; D303-Q305 WeakPolarHBondContact OD1-CG 3.36Å; D303-Q305 PolarHBondContact OD1-NE2 2.95Å; D303-Q305 PolarHBondContact OD2-NE2 2.85Å
304	R	62	Low	68.8	Low	208 Å²	208	139.1 Å²	139.1	79%	0.785	69%	0.687	S	S	*	*			trans	-65.6	21.9	173	-83.1	-172.1	170.5	-171.9	-1.3	113.8	Y302 G306 I307	Y302-R304 VanDerWaalsContact C-N 3.33Å; Y302-R304 PolarHBondContact O-N 3Å; R304-G306 PolarHBondContact O-N 3.33Å; R304-I307 PolarHBondContact O-N 2.97Å
305	Q	56.6	Low	66.2	Low	164 Å²	164	141.5 Å²	141.5	77%	0.766	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-3.3	-179.2	-87.5	-174.3	57.9	0	0	114.8	D303	D303-Q305 PolarHBondContact O-N 3.34Å; D303-Q305 VanDerWaalsContact OD1-CG 3.23Å; D303-Q305 WeakPolarHBondContact OD1-CG 3.36Å; D303-Q305 PolarHBondContact OD1-NE2 2.95Å; D303-Q305 PolarHBondContact OD2-NE2 2.85Å
306	G	55.5	Low	63.6	Low	74 Å²	74	151.2 Å²	151.2	76%	0.763	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	-18.4	175	0	0	0	0	0	117.6	R304	R304-G306 PolarHBondContact O-N 3.33Å
307	I	52.5	Low	62	Low	154 Å²	154	154.5 Å²	154.5	79%	0.79	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.8	-17.2	-164.8	-62	174.7	0	0	0	113.5	R304	R304-I307 PolarHBondContact O-N 2.97Å
308	G	50.9	Low	60.4	Low	73 Å²	73	155.3 Å²	155.3	75%	0.753	76%	0.759	S	S	*	*	S	Bend	trans	-100.7	-1.8	-171.6	0	0	0	0	0	118
309	R	50.3	Low	58.5	Low	241 Å²	241	158.8 Å²	158.8	91%	0.909	78%	0.779	S	S	*	*	S	Bend	trans	-123	29.3	-167.7	-111.2	-177.4	-179.3	179.8	0.3	116.2
310	R	50.7	Low	56.5	Low	245 Å²	245	164.1 Å²	164.1	93%	0.925	80%	0.803	S	S	*	*	S	Bend	trans	-128.9	63.9	166.5	-83.2	-171.9	176	176.6	0	111.7
311	M	48.3	Very low	54.4	Low	191 Å²	191	166.6 Å²	166.6	94%	0.941	81%	0.806	S	S	*	*			trans	-173	87.6	153.3	-111.3	-172.9	-174.5	0	0	110
312	R	43.2	Very low	52.1	Low	255 Å²	255	169 Å²	169	96%	0.962	81%	0.814	S	S	*	*			trans	-149.4	96.6	144.7	-125.9	177.1	179.6	171.3	-0.2	106.9
313	G	40.6	Very low	50.1	Low	69 Å²	69	169.2 Å²	169.2	71%	0.711	83%	0.826	S	S	*	*			trans	-62.2	147.8	179.4	0	0	0	0	0	111.2	F315	G313-F315 PolarHBondContact O-N 3.27Å
314	L	45.8	Very low	49	Very low	172 Å²	172	177.1 Å²	177.1	90%	0.901	86%	0.862	S	S	*	*			trans	-49.5	115.9	151.6	-76.4	125.3	0	0	0	109.1
315	F	39.9	Very low	47.9	Very low	184 Å²	184	174.5 Å²	174.5	81%	0.807	87%	0.868	S	S	*	*			trans	-147.9	112.5	149.7	-89.1	-73.1	0	0	0	108	G313	G313-F315 PolarHBondContact O-N 3.27Å
316	F	41	Very low	47.1	Very low	272 Å²	272	175.5 Å²	175.5	100%	1.193	88%	0.878	S	S	*	*			trans	53.4	0	166.2	-67.6	-81	0	0	0	119.2

Retrieved 316 of 316 residues in 997 ms (Link to these results)

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